{"id":4268,"date":"2023-03-19T23:50:04","date_gmt":"2023-03-19T14:50:04","guid":{"rendered":"https:\/\/www.pirika.com\/wp\/%e6%b2%b8%e7%82%b9%e3%81%ae%e6%8e%a8%e7%ae%97%e6%b3%95"},"modified":"2026-03-25T10:07:39","modified_gmt":"2026-03-25T01:07:39","slug":"bp-theory","status":"publish","type":"page","link":"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/bp-theory","title":{"rendered":"\u6cb8\u70b9\u306e\u63a8\u7b97\u6cd5\u3068\u8a08\u7b97\u30a2\u30d7\u30ec\u30c3\u30c8"},"content":{"rendered":"\n<link rel=\"stylesheet\" href=\"https:\/\/www.pirika.com\/Images20\/TT.css\">\n<link rel=\"stylesheet\" href=\"https:\/\/www.pirika.com\/Images20\/title.css\">\n\n<p align=\"right\">2025.11.45<\/p>\n\n<iframe src=\"https:\/\/www.pirika.com\/title.html\" width=\"100%\" id=\"inner-flame\"><\/iframe>\n\n\n\n<p><strong><a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\">pirika.com\u3067\u5316\u5b66<\/a> <\/strong><br>&gt;<strong><a 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class=\"wp-block-heading\">Pirika\u3067\u63d0\u4f9b\u3059\u308b\u30d7\u30ed\u30b0\u30e9\u30e0<\/h3>\n\n\n\n<p>2011-2024\u5e74\u6a2a\u6d5c\u56fd\u5927(YNU)\u3067\u884c\u306a\u3063\u305f\u6388\u696d\u3067\u4f7f\u3063\u305fYNU-YMB\u3092\u516c\u958b\u3057\u305f\u3002<br>\u91cd\u539f\u5b50\u306f15\u307e\u3067\u3001CHNO\u4ee5\u5916\u306e\u539f\u5b50\u306f\uff11\u4ee5\u4e0b\u3002\u30d1\u30e9\u30e1\u30fc\u30bf\u306f2013\u5e74\u306e\u3082\u306e\u306a\u306e\u3067\u53e4\u3044\u3002<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/cheminfo\/chemo-info\/free-tool\/jsme-h2u\">JSME\u306e\u4f7f\u3044\u65b9<\/a>\u306f\u3053\u3061\u3089\u3092\u53c2\u7167\u3057\u3066\u6b32\u3057\u3044\u3002<\/p>\n\n\n\n<iframe loading=\"lazy\" src=\"https:\/\/www.pirika.com\/Program\/TCPE\/YNU24-F\/JSME-BP.html\" width=\"700\" height=\"650\"  scrolling=\"no\">\n<p>Please Use HTML5 Browser<\/p>\n<\/iframe>\n\n\n\n<h2 class=\"wp-block-heading\">\u4ee5\u964d\u30012011.6.15\u306e\u53e4\u3044\u8a18\u8ff0\u3002<\/h2>\n\n\n\n<details>\n\n\n\n<p><\/p>\n\n\n\n<p>HTML5\u5236\u9650\u30d0\u30fc\u30b8\u30e7\u30f3\uff08\u7d71\u5408\u5316\u30d0\u30fc\u30b8\u30e7\u30f3 2011.6.13\uff09<br>\uff08Pass Code\u304c\u306a\u3044\u5834\u5408\u3001\u91cd\u539f\u5b50\u306f\uff18\u3064\u307e\u3067\u3002S, F, Cl\u306f\u4f7f\u3048\u306a\u3044\uff09<\/p>\n\n\n\n<iframe loading=\"lazy\" src=\"https:\/\/www.pirika.com\/Program\/TCPE\/BPCriVP\/index.html\" width=\"700\" height=\"650\"  scrolling=\"no\">\n<p>Please Use HTML5 Browser<\/p>\n<\/iframe>\n\n\n\n<p>\uff08<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/how2useh5\">\u5206\u5b50\u306e\u63cf\u304d\u65b9\u306f\u3053\u3061\u3089\u3092\u53c2\u7167\u3057\u3066\u304f\u3060\u3055\u3044\u3002<\/a>\uff09<\/p>\n\n\n\n<p>iPhone\/ipod Touch\u3092\u304a\u4f7f\u3044\u306e\u65b9\u306f<a href=\"https:\/\/www.pirika.com\/Program\/TCPE\/iVP-T\/index.html\">\u3053\u3061\u3089\u306e\u30d7\u30ed\u30b0\u30e9\u30e0<\/a>\u3092\u8a66\u3057\u3066\u9802\u304d\u305f\u3044\u3002\uff08\u30de\u30a6\u30b9\u3067\u306f\u30bf\u30c3\u30c1\u30a4\u30d9\u30f3\u30c8\u304c\u767a\u751f\u3057\u306a\u3044\u306e\u3067\u5206\u5b50\u304c\u63cf\u3051\u306a\u3044\uff09<\/p>\n\n\n\n<h4 class=\"wp-block-heading\">\u305d\u306e\u4ed6\u306e\u30d0\u30fc\u30b8\u30e7\u30f3<\/h4>\n\n\n\n<ul class=\"wp-block-list\">\n<li><a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/h2u-joback-h5\">Joback\u6cd5\u30fcHTML5\u30d0\u30fc\u30b8\u30e7\u30f3<\/a>\uff08\u7d71\u5408\u5316\u30d0\u30fc\u30b8\u30e7\u30f3 2011.4.16\uff09<\/li>\n\n\n\n<li><a href=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/YMB.html\">YMB\u30b7\u30df\u30e5\u30ec\u30fc\u30bf<\/a>\uff08HTML5 \u30d7\u30ed\u30b0\u30e9\u30e0 2011.6.10\u3000<mark style=\"background-color:#ffef8e\" class=\"has-inline-color has-dark-gray-color\">Pass Code\u3092\u6301\u3063\u3066\u3044\u308b\u306a\u3089\u3053\u3061\u3089\u306e\u65b9\u304c\u7cbe\u5ea6\u304c\u9ad8\u3044<\/mark>\uff09<\/li>\n<\/ul>\n\n\n\n<\/details>\n\n\n\n<p><\/p>\n\n\n\n<p>\u6700\u65b0\u306e\u65b9\u6cd5\u306fPirikaPro4MI(Pirika.com\u793e\u88fd\u30bd\u30d5\u30c8\uff09\u306b\u642d\u8f09\u3055\u308c\u3066\u3044\u308b\u3002<br>HSPiP\u306b\u642d\u8f09\u306e\u5546\u7528\u7248(<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/hsp\/how2buy\">Hansen-Solubility.com\u304b\u3089\u8ca9\u58f2<\/a>)\u3067\u306f\u3001F, Cl, Br, I,S, P, B, Si\u304c\u4f7f\u3048\u308b\u3002\u82b3\u9999\u65cf\u3082\u6271\u3048\u3001\u6700\u5927\u91cd\u539f\u5b50\u6570\u306f120\u306b\u306a\u308b\u3002<\/p>\n\n\n\n<ul class=\"wp-block-list\">\n<li><a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/hsp\/hspip\">HSPiP\u306e\u6a5f\u80fd\u6982\u8981<\/a><\/li>\n<\/ul>\n\n\n\n<p>\u30d7\u30ed\u30b0\u30e9\u30e0\u306b\u3088\u3063\u3066<a href=\"https:\/\/www.pirika.com\/Program\/TCPE\/GroupList.html\">\u3069<\/a><a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/grouplist\">\u3093\u306a\u539f\u5b50\u56e3\u304c\u4f7f\u3048\u308b\u304b<\/a>\u306f\u3053\u3061\u3089\u3067\u78ba\u8a8d\u306e\u3053\u3068<\/p>\n\n\n\n<p>\u65b0\u3057\u3044\u539f\u5b50\u56e3\u5bc4\u4e0e\u6cd5\u3092\u4f7f\u3063\u305f\u6cb8\u70b9\u306e\u63a8\u7b97\u6cd5\u304cpirika.com\u793e\u3067\u958b\u767a\u3055\u308c\u3066\u3044\u308b\u3002<br><a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/cheminfo\/chemo-info\/group\/dgc\">\u539f\u5b50\u56e3\u5bc4\u4e0e\u6cd5\u306e\u7c21\u4fbf\u3055\u3068\u3001\u539f\u5b50\u56e3\u306e\u7d50\u5408\u60c5\u5831\u3082\u6b8b\u3057\u305f\u63a8\u7b97\u6cd5<\/a>(JBDGC)\u3092\u4f7f\u3063\u305f\u3082\u306e\u3067\u3001\u7cbe\u5ea6\u304c\u5411\u4e0a\u3057\u305f\u3002<\/p>\n\n\n\n<h3 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\u306e\u3082\u3068\u3067\u306e\u6cb8\u70b9\u3092\u6a19\u6e96\u6cb8\u70b9\u3042\u308b\u3044\u306f\u5358\u306b\u6cb8\u70b9\u3068\u3044\u3046\u3002<br><br>\u6eb6\u6db2\u306e\u6cb8\u70b9\u306f\u5916\u5727\u304c\u4e00\u5b9a\u3067\u3042\u3063\u3066\u3082\u7d44\u6210\u306e\u5909\u5316\u306b\u5fdc\u3058\u3066\u5909\u5316\u3059\u308b\u3002\u3053\u308c\u306b\u95a2\u3057\u3066\u306f<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/chemeng\/antoinetheory\">\u6c17\u6db2\u5e73\u8861\u3067\u8aac\u660e\u3059\u308b<\/a>\u3002<\/p>\n\n\n\n<p><strong>\u6cb8\u9a30\u3068\u306f<\/strong>\uff1a\u4e00\u5b9a\u5727\u529b\u306e\u3082\u3068\u3067\u6db2\u4f53\u304c\u3042\u308b\u4e00\u5b9a\u6e29\u5ea6\u306b\u9054\u3059\u308b\u3068\u3001\u6db2\u4f53\u8868\u9762\u304b\u3089\u306e\u84b8\u767a\u306e\u307b\u304b\u306b\u3001\u6db2\u4f53\u5185\u90e8\u304b\u3089\u3082\u6c17\u5316\u304c\u304a\u3053\u308a\u59cb\u3081\u308b\u3002<br>\u3053\u306e\u6db2\u4f53\u5185\u90e8\u304b\u3089\u304a\u3053\u308b\u6c17\u5316\u73fe\u8c61\u3092\u6cb8\u9a30 \u3068\u3044\u3044\u3001\u6cb8\u9a30\u304c\u304a\u3053\u308b\u6e29\u5ea6\u3092\u6cb8\u70b9\u3068\u3044\u3046\u3002<br>\u6cb8\u70b9\u3067\u306f\u3001\u305d\u306e\u6db2\u4f53\u306e\u84b8\u6c17\u5727\u306f\u5916\u5727\uff08\u901a\u5e38\uff11atm\uff09\u306b\u7b49\u3057\u3044\u3002<br><br>\u7d14\u7c8b\u6db2\u4f53\u3067\u306f\u4e00\u5b9a\u5727\u529b\u306e\u3082\u3068\u3067\u6cb8\u70b9\u306f\u4e00\u5b9a\u306b\u4fdd\u305f\u308c \u308b\u3002<br>\u5668\u58c1\u307e\u305f\u306f\u6db2\u4e2d\u306e\u3054\u307f\u306a\u3069\u304c\u7a2e\u306b\u306a\u308a\u3001\u6cb8\u9a30\u304c\u306f\u3058\u307e\u308b\u3068\u8003\u3048\u3089\u308c\u308b\u3002<br>\u7a2e\u306e\u5b58\u5728\u3092\u3067\u304d\u308b\u3060\u3051\u5c11\u306a\u304f\u3059\u308b\u3068\u3001\u904e\u71b1\u304c\u751f\u3058\u308b\u3053\u3068\u304c\u3042\u308b\u3002<\/p>\n\n\n\n<p>\u6cb8\u9a30\u306e\u79d1\u5b66\u306b\u3064\u3044\u3066\u307e\u3068\u3081\u305f\u3002<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/boilingsci\">\u3053\u3061\u3089\u304b\u3089\u53c2\u7167<\/a>\u3057\u3066\u307b\u3057\u3044\u3002<\/p>\n\n\n\n<h3 class=\"wp-block-heading\">\u63a8\u7b97\u6cd5<\/h3>\n\n\n\n<p>\u84b8\u6c17\u5727\u306e\u63a8\u7b97\u306b\u306f\u3044\u304f\u3064\u304b\u306e\u65b9\u6cd5\u304c\u77e5\u3089\u308c\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<ul class=\"wp-block-list\">\n<li>Meissner<\/li>\n\n\n\n<li>Lydersen, Forman, Thodos, JOBACK<\/li>\n\n\n\n<li>Miller<\/li>\n\n\n\n<li>Ogata and Tsuchida<\/li>\n\n\n\n<li>Somayajulu and Palit<\/li>\n\n\n\n<li>Kinney<\/li>\n\n\n\n<li>Stiel and Thodos<\/li>\n<\/ul>\n\n\n\n<p>\u4e00\u756a\u57fa\u790e\u306b\u306a\u308b\u65b9\u6cd5\u306f<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/joback\">Joback\u306e\u539f\u5b50\u56e3\u5bc4\u4e0e\u6cd5<\/a>\uff08Wiki Pedia)\u306b\u3088\u308b\u3082\u306e\u3060\u308d\u3046\u3002\u3053\u306e\u65b9\u6cd5\u306f\u5404\u539f\u5b50\u56e3\u306b\u3001\u539f\u5b50\u56e3\u304c\u4e00\u3064\u5897\u3048\u308b\u3054\u3068\u306b\u3001\u6cb8\u70b9\u304c\u3069\u308c\u3060\u3051\u5897\u3048\u308b\u306e\u304b\u3068\u3044\u3046\u52a0\u7b97\u5024\u3092\u6c42\u3081\u3001\u305d\u306e\u8db3\u3057\u5408\u308f\u305b\u3067\u6cb8\u70b9\u3092\u4e88\u6e2c\u3059\u308b\u3082\u306e\u3060\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/douzoku.gif\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>\u4f8b\u3048\u3070\u3001\u30d7\u30ed\u30d1\u30f3\u304b\u3089\u30c7\u30ab\u30f3\u307e\u3067\u306e\u6cb8\u70b9\u3092\u70ad\u7d20\u6570\u306b\u5bfe\u3057\u3066\u30d7\u30ed\u30c3\u30c8\u3059\u308b\u3068\u4e0a\u306e\u56f3\u306e\u3088\u3046\u306b\u306a\u308a\u3001\u70ad\u7d20\u304c\u4e00\u3064\uff08CH2\u304c\u3072\u3068\u3064\uff09\u5897\u3048\u308b\u306830.49\u2103\u6cb8\u70b9\u304c\u4e0a\u6607\u3059\u308b\u3053\u3068\u304c\u308f\u304b\u308b\u3002<\/p>\n\n\n\n<p>\u540c\u3058\u7d44\u6210\u5f0f\u3001\u4f8b\u3048\u3070C6H14\u3067\u3082\u5206\u5b50\u306e\u5f62\u72b6\u3001\u3059\u306a\u308f\u3061\u3001\u679d\u5225\u308c\u306e\u72b6\u614b\u306b\u3088\u3063\u3066\u6cb8\u70b9\u306f\u5909\u308f\u3063\u3066\u304f\u308b\u3002<br>\u30d8\u30ad\u30b5\u30f3\uff0868\u2103\uff09\u30013-\u30e1\u30c1\u30eb\u30da\u30f3\u30bf\u30f3\uff0863\u2103\uff09\u3001\u30a4\u30bd\u30d8\u30ad\u30b5\u30f3\uff0860\u2103\uff09\u30012,3-\u30b8\u30e1\u30c1\u30eb\u30d6\u30bf\u30f3\uff0858\u2103\uff09\u3001\u30cd\u30aa\u30d8\u30ad\u30b5\u30f3\uff0849\u2103\uff09<\/p>\n\n\n\n<p>\u305d\u3053\u3067\u3001CH\u3084C\u3068\u3044\u3046\u539f\u5b50\u56e3\u3092\u5b9a\u7fa9\u3057\u3066\u52a0\u7b97\u5024\u3092\u6c42\u3081\u3066\u3044\u304f\u3002<\/p>\n\n\n\n<p>\u3053\u3046\u3057\u305f\u4e8b\u309240\u500b\u7a0b\u5ea6\u306e\u539f\u5b50\u56e3\u306b\u5bfe\u3057\u3066\u7d71\u8a08\u7684\u306b\u5b9a\u3081\u305f\u306e\u304c<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/joback\">Joback\u6cd5<\/a>\u3060\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/BPAc1.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>(R)\u304c\u3064\u3044\u3066\u3044\u308b\u539f\u5b50\u56e3\u306f\u74b0\u72b6\u5316\u5408\u7269\u306b\u9069\u7528\u3059\u308b\u3002(phe)\u306f\u30d5\u30a7\u30ce\u30fc\u30eb\u306eOH\u3067\u3042\u308b\u3002<\/p>\n\n\n\n<p>Joback\u3068Reid\u306f1987\u5e74\u306b\u8102\u80aa\u65cf\u3068\u82b3\u9999\u65cf\u70ad\u5316\u6c34\u7d20\u306e\u6cb8\u70b9\u306e\u6982\u7b97\u5024\u3092\u30b0\u30eb\u30fc\u30d7\u5bc4\u4e0e\u6cd5\u3092\u7528\u3044\u3066\u8a08\u7b97\u3059\u308b\u65b9\u6cd5\u3092\u63d0\u6848\u3057\u305f\u3002\u6cb8\u70b9\u306f\u5206\u5b50\u3092\u69cb\u6210\u3059\u308b\u90e8\u5206\u69cb\u9020\u306e\u5bc4\u4e0e\u306e\u7dcf\u548c\u3067\u63a8\u7b97\u3055\u308c\u308b\u3002<\/p>\n\n\n\n<p>Tb=198.2+sigma(ni * deltabi)<\/p>\n\n\n\n<p>Tb: \u6a19\u6e96\u6cb8\u70b9,[K]<br>ni: i\u756a\u76ee\u306e\u90e8\u5206\u69cb\u9020\u306e\u6570<br>deltabi: JOBACK\u306ei\u756a\u76ee\u306e\u90e8\u5206\u69cb\u9020\u306e\u6cb8\u70b9\u306b\u5bfe\u3059\u308b\u5bc4\u4e0e\u5ea6, [K]<\/p>\n\n\n\n<p>\u3053\u306e\u8a08\u7b97\u5f0f\u306f\u6cb8\u70b9\u304c500K\u3092\u8d85\u3048\u308b\u5834\u5408\u306b\u306f\u904e\u5927\u8a55\u4fa1\u3092\u3059\u308b\u50be\u5411\u304c\u3042\u308b\u3002<br>\u6b21\u306e\uff12\u3064\u306e\u591a\u9805\u5f0f\u304c\u3053\u306e\u554f\u984c\u3092\u4fee\u6b63\u3059\u308b\u3002<\/p>\n\n\n\n<p>Tb(corr)=Tb &#8211; 94.84 + 0.5577 Tb &#8211; 0.0007705 Tb2, (Tb &lt; 700K) Tb(corr)=Tb+282.7 &#8211; 0.5209 Tb, (Tb &gt; 700K)<\/p>\n\n\n\n<p>\u3057\u304b\u308b\u3079\u304d\u591a\u9805\u5f0f\u3092\u4f7f\u3063\u305f\u5834\u5408\u306b\u306f\uff0c\u3053\u306e\u30e2\u30c7\u30eb\u306f\u7d76\u5bfe\u8aa4\u5dee15.5K\uff0c\u305d\u3057\u3066\u5e73\u5747\u7684\u306a\uff05\u8aa4\u5dee\u306f3.2\uff05\u3092\u4e0e\u3048\u308b\u3002<br>Joback\u6cd5\u306b\u3088\u308b\u6cb8\u70b9\u63a8\u7b97\u306b\u3064\u3044\u3066\u3055\u3089\u306b\u8a73\u3057\u304f\u77e5\u308a\u305f\u3044\u65b9\u306f\u3001<\/p>\n\n\n\n<p>McGRAW-Hill International Editions\u30001987<br>The Properties of GASES &amp; LIQUIDS 4th Edition<br>Robert C.Reid, John M. Prausnitz, Bruce E. oling<br>\u3092\u53c2\u7167\u306e\u3053\u3068<\/p>\n\n\n\n<p>\u975e\u5e38\u306b\u7c21\u4fbf\u3067\u306f\u3042\u308b\u304c\u3001\u3053\u306e\u65b9\u6cd5\u306e\u6b20\u70b9\u306f\u5b9a\u7fa9\u3055\u308c\u3066\u3044\u306a\u3044\u539f\u5b50\u56e3\u304c\u3042\u308b\u3068\u8a08\u7b97\u3067\u304d\u306a\u304f\u306a\u308b\u70b9\u3060\u3002<br>\u4f8b\u3048\u3070\u30a2\u30df\u30c9\uff08C(=O)NH2\uff09\u306f\u30b1\u30c8\u30f3\uff08&gt;C=O\uff09\u3068\u30a2\u30df\u30f3(NH2)\u306e\u8db3\u3057\u3042\u308f\u305b\u306b\u306f\u306a\u3089\u306a\u3044\u3002<br><br>\u3055\u3089\u306b\u3001\u5206\u5b50\u3092\u539f\u5b50\u56e3\u306b\u5206\u5272\u3059\u308b\u969b\u306b\u539f\u5b50\u56e3\u540c\u58eb\u306e\u7d50\u5408\u60c5\u5831\u304c\u5931\u308f\u308c\u308b\u3068\u3044\u3046\u6b20\u70b9\u3092\u6301\u3064\u3002<br>\u305d\u3053\u3067\u30a2\u30df\u30ce\u9178\uff08RC(NH2)COOH\uff09\u306e\u3088\u3046\u306b\u30a2\u30df\u30f3\u3068\u30ab\u30eb\u30dc\u30f3\u9178\u304c\u4e00\u3064\u306e\u70ad\u7d20\u306b\u3064\u3044\u3066\u3044\u308b\u5834\u5408\u306b\u306f\u3001\u6211\u3005\u306f\u3053\u308c\u304c\u56fa\u4f53\u306b\u306a\u308a\u3001\u591a\u304f\u306e\u5834\u5408\u3001\u6cb8\u70b9\u306f\u6301\u305f\u305a\u3001\u52a0\u71b1\u3059\u308b\u3068\u5206\u89e3\u3057\u3066\u3057\u307e\u3046\u3053\u3068\u3092\u77e5\u3063\u3066\u3044\u308b\u3002<br><br>\u3057\u304b\u3057\u3001\u539f\u5b50\u56e3\u306b\u5206\u5272\u3057\u3066\u3057\u307e\u3046\u3068\u30a2\u30df\u30f3\u3068\u30ab\u30eb\u30dc\u30f3\u9178\u306e\u52a0\u7b97\u56e0\u5b50\u5206\u3060\u3051\u4e0a\u6607\u3057\u305f\u6cb8\u70b9\u3092\u7b54\u3048\u3068\u3057\u3066\u8fd4\u3057\u3066\u3057\u307e\u3046\u3002<br><br>\u307e\u305f\u3001\u3053\u3046\u3057\u305f\u7dda\u5f62\u5f0f\u306f\u540c\u3058\u8907\u6570\u306e\u5b98\u80fd\u57fa\u304c\u5c0e\u5165\u3055\u308c\u308b\u3054\u3068\u306b\u4e0a\u6607\u7387\u304c\u3060\u3093\u3060\u3093\u4e0b\u304c\u308b\u3068\u3044\u3063\u305f\u975e\u7dda\u5f62\u6027\u306b\u306f\u8ffd\u968f\u3067\u304d\u306a\u3044\u3002\u4e0a\u306e\u30d7\u30ed\u30d1\u30f3\u304b\u3089\u30c7\u30ab\u30f3\u306e\u6cb8\u70b9\u306e\u56f3\u3067\u3082\u3001\u3060\u3093\u3060\u3093\u4e0a\u6607\u7387\u306f\u4e0b\u304c\u3063\u3066\u3044\u308b\u306e\u304c\u308f\u304b\u308b\u3060\u308d\u3046\u3002<\/p>\n\n\n\n<p>\u3053\u3046\u3057\u305f\u3001\u5b98\u80fd\u57fa\u9593\u76f8\u4e92\u4f5c\u7528\u3068\u975e\u7dda\u5f62\u6027\u3092\u540c\u6642\u306b\u6e80\u305f\u3059\u89e3\u6790\u65b9\u6cd5\u3068\u3057\u3066\u3001\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u6cd5\uff08NN\u6cd5\uff09\u304c\u4f7f\u308f\u308c\u308b\u4f8b\u3082\u591a\u3044\u3002NN\u6cd5\u306f\u8a18\u8ff0\u6027\u306f\u9ad8\u3044\u304c\u3001\u4e88\u6e2c\u6027\u304c\u4f4e\u304f\u3001\u307e\u305f\u7d50\u679c\u3092Joback\u6cd5\u306e\u3088\u3046\u306b\u7c21\u5358\u306b\u691c\u8a3c\u3059\u308b\u3053\u3068\u3082\u3067\u304d\u306a\u3044\u306e\u3067\u3001\u4f7f\u3044\u65b9\u306f\u3068\u3066\u3082\u96e3\u3057\u3044\u3002<br><br>Pirika\u306e\u53e4\u3044JAVA\u306e\u7269\u6027\u63a8\u7b97\u6cd5\u306fNN\u6cd5\u3092\u4f7f\u3063\u3066\u3044\u308b\u3002\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u304c\u3069\u306e\u3088\u3046\u306b\u5b66\u7fd2\u3092\u9032\u3081\u3066\u3044\u304f\u304b\u306f\u3001<a href=\"https:\/\/www.pirika.com\/Education\/JP\/ChemInfo\/NNMechanism.html\">\u3053\u3061\u3089\u306e\u30c7\u30e2<\/a>\u3092\u3054\u89a7\u9802\u304d\u305f\u3044\u3002<\/p>\n\n\n\n<p>\u305d\u308c\u3067\u306f\u3001\u7dda\u5f62\u56de\u5e30\u3092\u4f7f\u3046\u304b\u3001\u975e\u7dda\u5f62\u56de\u5e30\u3092\u4f7f\u3046\u304b\u306f\u5225\u3068\u3057\u3066\u3001\u3069\u3046\u3084\u3063\u305f\u3089\u3053\u306eJoback\u6cd5\u3092\u6539\u826f\u3067\u304d\u308b\u304b\u3092\u8003\u3048\u3066\u307f\u3088\u3046\u3002<br><br>\u4f8b\u3048\u3070\u3053\u306eJoback\u6cd5\u306e\u30c6\u30fc\u30d6\u30eb\u306b\u306f\u30cf\u30ed\u30b2\u30f3\u539f\u5b50\u306f\u5358\u4f53\u306e4\u3064\u3057\u304b\u306a\u3044\u3002\u305d\u3053\u3067\u3001\u4f8b\u3048\u3070C3H3F5O\u3068\u3044\u3046\u69cb\u9020\u3092\u30c7\u30fc\u30bf\u30d9\u30fc\u30b9\u304b\u3089\u6cb8\u70b9\u3092\u63a2\u7d22\u3057\u3066\u307f\u308b\u3068\u3001\u6cb8\u70b9\u306f48\u2103\u7570\u306a\u308b\u3082\u306e\u304c\u3042\u308b\u3053\u3068\u304c\u308f\u304b\u308b\u3002<br>Joback\u306e\u30c6\u30fc\u30d6\u30eb\u3067\u3001CH3, CH2, CH, C\u306e\u52a0\u7b97\u56e0\u5b50\u304c5\u2103\u7a0b\u5ea6\u306e\u9055\u3044\u3057\u304b\u4e0e\u3048\u306a\u3044\u3053\u3068\u304b\u3089\u3001Joback\u6cd5\u3067\u30d5\u30ed\u30f3\u4ee3\u66ff\u306e\u5316\u5408\u7269\u3092\u7269\u6027\u63a8\u7b97\u3057\u3066\u8a2d\u8a08\u3059\u308b\u3053\u3068\u306f\u4e0d\u53ef\u80fd\u3067\u3042\u308b\u3053\u3068\u304c\u308f\u304b\u308b\u3060\u308d\u3046\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/BPAc2.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p><br>\u30c7\u30fc\u30bf\u30d9\u30fc\u30b9\u304b\u3089\u30cf\u30ed\u30b2\u30f3\u539f\u5b50\u3092\u542b\u3080\u5316\u5408\u7269\u3060\u3051\u3092\u53d6\u308a\u51fa\u3057\u3066\u3001Joback\u6cd5\u3067\u6cb8\u70b9\u3092\u63a8\u7b97\u3059\u308b\u3068\u4e0b\u306e\u30b0\u30e9\u30d5\u306e\u3088\u3046\u306b\u306a\u308a\u3001\u5e73\u5747\u306795.2K\u305a\u308c\u3066\u3057\u307e\u3046\u3053\u3068\u304c\u308f\u304b\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/BPAc3.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>\u305d\u3053\u3067\u3001\u30cf\u30ed\u30b2\u30f3\u539f\u5b50\u306e\u539f\u5b50\u56e3\u3092\u8ffd\u52a0\u3059\u308b\u3053\u3068\u306b\u3088\u3063\u3066\u63a8\u7b97\u7cbe\u5ea6\u306e\u5411\u4e0a\u3092\u56f3\u308b\u3053\u3068\u306b\u3059\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/BAAc4.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p><br>\u3059\u308b\u3068\u3001\u63a8\u7b97\u7cbe\u5ea6\u306f\u975e\u5e38\u306b\u5411\u4e0a\u3059\u308b\u4e8b\u304c\u308f\u304b\u308b\u3002\u5e73\u5747\u8aa4\u5dee\u306f10.5K\u7a0b\u5ea6\u306b\u306a\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/BPAc5.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p><br>\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u6cd5\u3092\u4f7f\u3046\u3068\u3055\u3089\u306b\u5e73\u5747\u8aa4\u5dee\u306f\u5c0f\u3055\u304f\u306a\u308b\u304c\u3001<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/cheminfo\/chemo-info\/nn-method\/overlearn\">\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u306e\u8cea\u304c\u60aa\u3044\u3068\u4e88\u6e2c\u6027\u80fd\u306f\u9006\u306b\u975e\u5e38\u306b\u60aa\u304f\u306a\u308b<\/a>\u3053\u3068\u304c\u3042\u308b\u3002<br><br>\u305d\u308c\u3092\u907f\u3051\u308b\u306b\u306f\u3001\u3068\u306b\u304b\u304f\u30c7\u30fc\u30bf\u3092\u5897\u3084\u3059\u3057\u304b\u306a\u3044\u3002\u30cf\u30ed\u30b2\u30f3\u5316\u5408\u7269\u3001\u82b3\u9999\u65cf\u5316\u5408\u7269\u3068\u30c7\u30fc\u30bf\u3092\u5897\u3084\u3059\u3068\u3001\u305d\u308c\u306b\u3042\u308f\u305b\u5b98\u80fd\u57fa\u306e\u6570\u3082\u5897\u3048\u3001\u5b98\u80fd\u57fa\u306e\u6570\u304c\u5897\u3048\u305f\u5206\u3001\u307e\u305f\u5b66\u7fd2\u3055\u305b\u308b\u30c7\u30fc\u30bf\u3092\u5897\u3084\u3059\u3068\u3044\u3046\u30a4\u30bf\u30c1\u3054\u3063\u3053\u304c\u5ef6\u3005\u3068\u7d9a\u304f\u3053\u3068\u306b\u306a\u308b\u3002<br><br>Pirika\u306e\u6700\u65b0\u306e\u65b9\u6cd5\u306f\u30011\u4e07\u3092\u8d85\u3048\u308b\u30c7\u30fc\u30bf\u30bb\u30c3\u30c8\u304b\u3089\u63a8\u7b97\u5f0f\u3092\u69cb\u7bc9\u3057\u305f\u3082\u306e\u3067\u3001\u5b98\u80fd\u57fa\u306f167\u7a2e\u985e\u5b9a\u7fa9\u3055\u308c\u3066\u3044\u308b\u3002<a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/grouplist\">\u305d\u306e\u4e00\u89a7\u306f\u3053\u3061\u3089<\/a>\u3092\u53c2\u7167\u3057\u3066\u3044\u305f\u3060\u304d\u305f\u3044\u3002<\/p>\n\n\n\n<p>4855\u5316\u5408\u7269\u306e\u6cb8\u70b9\u304b\u3089\u3001\u3053\u306e\u3050\u3089\u3044\u306e\u7cbe\u5ea6\u3067\u6cb8\u70b9\u3092\u63a8\u7b97\u3059\u308b\u5f0f\u304c\u642d\u8f09\u3055\u308c\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/BPAc6.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p><br>\u3053\u306e\u6a5f\u80fd\u306fHSPiP(Hansen Solubility Parameters in Practice)\u3068\u3044\u3046\u30d7\u30ed\u30b0\u30e9\u30e0\u306b\u642d\u8f09\u3055\u308c\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/HSP\/JP\/Examples\/Docs\/images\/BPhis22.png\" alt=\"pirika\u306e\u6cb8\u70b9\u63a8\u7b97\"\/><\/figure>\n\n\n\n<p>\u3055\u3089\u306b\u3053\u308c\u3092\u6539\u826f\u3059\u308b\u306b\u306f\u3069\u3046\u3057\u305f\u3089\u826f\u3044\u3060\u308d\u3046\u304b\uff1f<br>\u539f\u5b50\u56e3\u5bc4\u4e0e\u6cd5\u306e\u554f\u984c\u70b9\u306e\u3046\u3061\u3001\u975e\u7dda\u5f62\u6027\u306b\u3064\u3044\u3066\u306fNN\u6cd5\u3092\u4f7f\u3048\u3070\u6539\u826f\u3067\u304d\u308b\u3002\u3057\u304b\u3057\u3001\u539f\u5b50\u56e3\u306e\u7d50\u5408\u60c5\u5831\u304c\u306a\u304f\u306a\u3063\u3066\u3057\u307e\u3046\u3053\u3068\u306b\u5bfe\u3057\u3066\u306fNN\u6cd5\u3092\u4f7f\u3063\u3066\u3082\u6539\u826f\u3067\u304d\u306a\u3044\u3002<br>QSPR\u6cd5\u3092\u4f7f\u3044\u3001\u8a18\u8ff0\u5b50\u3068\u3057\u3066\u539f\u5b50\u56e3\u3067\u306f\u306a\u304f\u3001\u5206\u5b50\u8ecc\u9053\u8a08\u7b97\u306e\u5f8c\u306b\u3001\u5206\u5b50\u4f53\u7a4d\u3001\u30d7\u30e9\u30b9\/\u30de\u30a4\u30ca\u30b9\u306b\u30c1\u30e3\u30fc\u30b8\u3055\u308c\u3066\u3044\u308b\u8868\u9762\u7a4d\u3001\u30c0\u30a4\u30dd\u30fc\u30eb\u30e2\u30fc\u30e1\u30f3\u30c8\u306a\u3069\u3092\u5165\u529b\u3059\u308b\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u3082\u958b\u767a\u3055\u308c\u3066\u3044\u308b\u3002<br>\u96fb\u8377\u5e73\u8861\u6cd5\u306b\u3088\u308b\u96fb\u8377\u306e\u8a08\u7b97\u3082\u975e\u5e38\u306b\u6709\u52b9\u3060\u3002<\/p>\n\n\n\n<p><a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/otherchem\/qeq2d\">2\u6b21\u5143QEQ\u6cd5<\/a>\u3067\u3082\u8aac\u660e\u3057\u305f\u304c\u3001C2H5\u3068\u3044\u3046\u539f\u5b50\u56e3\u306e\u52a0\u7b97\u56e0\u5b50\u3092\u70ad\u5316\u6c34\u7d20\u5316\u5408\u7269\u306e\u307f\u304b\u3089\u3064\u304f\u308b\u3068C2H5\u306f\u975e\u5e38\u306b\u975e\u6975\u6027\u306a\u57fa\u306b\u306a\u308a\u3001\u6cb8\u70b9\u306e\u52a0\u7b97\u5024\u3082\u5c0f\u3055\u304f\u306a\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/YNUI9.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>\u540c\u69d8\u306bC4F10\u3082\u5206\u5b50\u8868\u9762\u306f\u30d5\u30c3\u7d20\u306b\u8986\u308f\u308c\u3066\u3044\u3066\u3001\u96fb\u8377\u3082\u307b\u307c\u4e00\u69d8\u306a\u306e\u3067\u3001C2F5\u3082\u975e\u6975\u6027\u306a\u57fa\u3067\u52a0\u7b97\u5024\u3082\u3055\u3089\u306b\u5c0f\u3055\u304f\u306a\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/YNUI10.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>\u3053\u306e2\u3064\u304c\u7d44\u307f\u5408\u308f\u3055\u3063\u305f\u5834\u5408\u3001\u4e21\u65b9\u5171\u52a0\u7b97\u5024\u304c\u5c0f\u3055\u3044\u306e\u3067\u3001\u6cb8\u70b9\u306e\u63a8\u7b97\u5024\u304c\u5c0f\u3055\u3081\u306a\u5024\u306b\u306a\u3063\u3066\u3057\u307e\u3046\u304c\u3001\u96fb\u8377\u5e73\u8861\u6cd5\u3067\u8a08\u7b97\u3059\u308b\u3068\u3001\u5927\u304d\u304f\u5206\u6975\u3057\u3066\u3044\u308b\u3053\u3068\u304c\u308f\u304b\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/YNUI12.jpg\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>\u3053\u308c\u3092\u88dc\u6b63\u9805\u3068\u3057\u3066\u53d6\u308a\u8fbc\u3080\u3053\u3068\u304c\u53ef\u80fd\u3067\u3042\u308c\u3070\u3001\u6cb8\u70b9\u306e\u63a8\u7b97\u3082\u683c\u6bb5\u306b\u7cbe\u5ea6\u304c\u3042\u304c\u308b\u3068\u8003\u3048\u3089\u308c\u308b\u3002<\/p>\n\n\n\n<p>2\u6b21\u5143QEQ\u306f\u975e\u5e38\u306b\u7c21\u5358\u306b\u96fb\u8377\u3092\u8a08\u7b97\u3067\u304d\u308b\u306e\u3067\u3001\u5c06\u6765\u304c\u697d\u3057\u307f\u306a\u6280\u8853\u3067\u3042\u308b\u3002<br><br>\u305d\u3046\u3057\u305f\u3082\u306e\u304c\u5b9f\u7528\u5316\u3059\u308b\u307e\u3067\u306f\u3001\u73fe\u5b9f\u7684\u306b\u306f\u5b9f\u9a13\u5024\u306e\u6cb8\u70b9\u3092\u4f7f\u3046\u3053\u3068\u3092\u63a8\u5968\u3057\u3066\u3044\u308b\u3002\u5316\u5b66\u5de5\u5b66\u3067\u53d6\u308a\u6271\u3046\u5316\u5408\u7269\u306e\u6cb8\u70b9\u304c\u4e0d\u660e\u306a\u3053\u3068\u306f\u7a00\u3067\u3042\u308d\u3046\u3002<br>\u6700\u60aa\u3001\u6cb8\u70b9\u304c\u65e2\u77e5\u306e\u5316\u5408\u7269\u3068\u30ac\u30b9\u30af\u30ed\u3092\u6253\u3066\u3070\u3001\u5927\u4f53\u306e\u6cb8\u70b9\u306f\u898b\u7a4d\u3082\u308c\u308b\u3002<\/p>\n\n\n\n<p>C6H14\u306e\u30d8\u30ad\u30b5\u30f3\uff0868\u2103\uff09\u30013-\u30e1\u30c1\u30eb\u30da\u30f3\u30bf\u30f3\uff0863\u2103\uff09\u3001\u30a4\u30bd\u30d8\u30ad\u30b5\u30f3\uff0860\u2103\uff09\u30012,3-\u30b8\u30e1\u30c1\u30eb\u30d6\u30bf\u30f3\uff0858\u2103\uff09\u3001\u30cd\u30aa\u30d8\u30ad\u30b5\u30f3\uff0849\u2103\uff09\u5206\u5b50\u306e\u5f62\u72b6\u52b9\u679c\u3092\u3055\u3089\u306b\u691c\u8a0e\u3057\u3066\u307f\u308b\u3002<br><br>\u3053\u3046\u3057\u305f\u5316\u5408\u7269\u306e\u5206\u5b50\u8868\u9762\u7a4d\u3092\u8a08\u7b97\u3057\u6cb8\u70b9\u306b\u5bfe\u3057\u3066\u30d7\u30ed\u30c3\u30c8\u3059\u308b\u3068\u4e0b\u306b\u793a\u3059\u56f3\u306b\u306a\u308b\u3002\u4e00\u5fdc\u8868\u9762\u7a4d\u304c\u5927\u304d\u304f\u306a\u308b\u3068\u6cb8\u70b9\u304c\u9ad8\u304f\u306a\u308b\u50be\u5411\u304c\u307f\u3089\u308c\u308b\u304c\u76f8\u95a2\u4fc2\u6570\u306f0.82898\u3068\u3042\u307e\u308a\u9ad8\u304f\u306a\u3044\u3002<br><br>\u6cb8\u70b9\u3067\u306f\u5206\u5b50\u306e\u904b\u52d5\u30a8\u30cd\u30eb\u30ae\u30fc\u304c\u5206\u5b50\u9593\u529b\u306b\u6253\u3061\u52dd\u3064\u3053\u3068\u304c\u5fc5\u8981\u306a\u306e\u3067\u3001\u63a5\u89e6\u9762\u7a4d\u306e\u5927\u304d\u3044\u5206\u5b50\u306f\u305d\u308c\u3060\u3051\u9ad8\u3044\u6e29\u5ea6\uff08\u904b\u52d5\u30a8\u30cd\u30eb\u30ae\u30fc\uff09\u304c\u5fc5\u8981\u3060\u3068\u8003\u3048\u3089\u308c\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<figure class=\"wp-block-image\"><img decoding=\"async\" src=\"https:\/\/www.pirika.com\/Chemistry\/JP\/TCPE\/images\/keizyou.gif\" alt=\"BP-estimation\"\/><\/figure>\n\n\n\n<p>\u3057\u304b\u3057\u3001\u307b\u3068\u3093\u3069\u540c\u3058\u5206\u5b50\u8868\u9762\u7a4d\u3067\u3042\u308b2,3-\u30b8\u30e1\u30c1\u30eb\u30d6\u30bf\u30f3\u3068\u30cd\u30aa\u30d8\u30ad\u30b5\u30f3\u3067\u6cb8\u70b9\u304c\uff19\u2103\u3082\u7570\u306a\u308b\u3053\u3068\u304b\u3089\u3001\u3053\u3046\u3057\u305f\u8868\u9762\u7a4d\u4ee5\u5916\u306e\uff08\u4f8b\u3048\u3070\u5206\u6975\u306e\uff09\u52b9\u679c\u306a\u3069\u3067\u6cb8\u70b9\u306e\u5024\u304c\u5909\u308f\u308b\u3068\u8003\u3048\u3089\u308c\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<p>\u4e00\u822c\u7684\u306b\u306f\u6b21\u306e\u3088\u3046\u306a\u4e8b\u304c\u77e5\u3089\u308c\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<ul class=\"wp-block-list\">\n<li>molecular size become larger, boiling point become larger.<\/li>\n\n\n\n<li>compare with spherical structure and stick type structure, spherical structure become lower boiling point. ( because of accessible surface area? )<\/li>\n\n\n\n<li>hydrogen bond make boiling point raise dramatically<\/li>\n\n\n\n<li>Dipole moment make boiling point (maybe) raise<\/li>\n\n\n\n<li>Halogen atom make boiling point bring down<\/li>\n<\/ul>\n\n\n\n<p>\u6cb8\u70b9\u3068\u5206\u5b50\u306e\u30c8\u30dd\u30ed\u30b8\u30fc\u306b\u3064\u3044\u3066\u306f\u3001<br>\u671d\u5009\u66f8\u5e97\u3000\u671d\u5009\u5316\u5b66\u8b1b\u5ea7\uff15\u3000\u69cb\u9020\u3068\u7269\u6027\u3000<br>\u7d30\u77e2\u3000\u6cbb\u592b\u3000\u3000\u4e38\u5c71\u3000\u6709\u6210\u3000\u8457<br>\u306b\u8a73\u3057\u304f\u66f8\u304b\u308c\u3066\u3044\u308b\u306e\u3067\u305d\u3061\u3089\u3092\u53c2\u8003\u306b\u3057\u3066\u304f\u3060\u3055\u3044\u3002<\/p>\n\n\n\n<h3 class=\"wp-block-heading\">\u6587\u732e\uff0899-2-4\u306e\u6642\u70b9\uff09\u3046\u30fc\u30fc\u30fc\u3093\u6700\u8fd1\u52c9\u5f37\u4e0d\u8db3\u3060\u306a\u3002\u3002\u3002<\/h3>\n\n\n\n<p>Prediction of Boiling points and Critical Temperatures of Industrially Important Organic Compounds from Molecular Structure<br>J. Chem. Inf. Comput. Sci. 1994, 34, P947-956<br>Leanne M. Egolf, Matthew D. Wessel, and Peter C. Jurs<br>Design Institute for Physical Property Data(DIPPR)\u306e\u30c7\u30fc\u30bf\u30d9\u30fc\u30b9\u3092\u89e3\u6790\u3002\u591a\u91cd\u7dda\u5f62\u56de\u5e30\u5206\u6790\u3068\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u3092\u7528\u3044\u3066298\u6709\u6a5f\u5316\u5408\u7269\u306e\u6cb8\u70b9\u3001\u81e8\u754c\u6e29\u5ea6\u3092\u691c\u8a0e\u3002<br>ADAPT\u3068\u3044\u3046\u30d7\u30ed\u30b0\u30e9\u30e0\u3092\u4f7f\u3044\u3001\u5404\u5206\u5b50\u306e\u30c7\u30b9\u30af\u30ea\u30d7\u30bf\uff08\u8a18\u8ff0\u5b50\uff09\u3092\u767a\u751f\u3055\u305b\u8a08\u7b97\u3092\u884c\u3063\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<p>Normal Boiling Points for Organic Compounds: Correlation and Prediction by a Quantitative Structure-Property Relationship<br>J. Chem. Inf. Comput. Sci. 1998, 38, P28-41<br>Alan R. Katritzky, Victor S. Lobanov, and Mati Karelson<br>C,H,N,O,S,F,Cl,Br,I\u3000\u3092\u542b\u3080612\u5206\u5b50\u306e\u6cb8\u70b9\u3092\u691c\u8a0e\u3002AMPAC AM1 \u3067\u5206\u5b50\u8ecc\u9053\u8a08\u7b97\u3092\u884c\u3044\u305d\u306e\u7d50\u679c\u3092CODESSA\u3068\u3044\u3046\u30d7\u30ed\u30b0\u30e9\u30e0\u306e\u5165\u529b\u306b\u4f7f\u3044\u3001\u5404\u5206\u5b50\u306e\u30c7\u30b9\u30af\u30ea\u30d7\u30bf\u3092\u767a\u751f\u3055\u305b\u8a08\u7b97\u3092\u884c\u3063\u3066\u3044\u308b\u3002<\/p>\n\n\n\n<p>Neural Network &#8211; Topological Indices Approach to the Prediction of Properties of Alkene<br>J. Chem. Inf. Comput. Sci. 1997, 37, P1146-1151<br>Shuhui Liu, Ruisheng Zhang, Mancang Liu, and Zhide Hu<br>\u30c8\u30dd\u30ed\u30b8\u30ab\u30eb\u6307\u6a19\u3092\u30cb\u30e5\u30fc\u30e9\u30eb\u30cd\u30c3\u30c8\u30ef\u30fc\u30af\u306e\u5165\u529b\u5024\u306b\u7528\u3044\u3066\u30a2\u30eb\u30b1\u30f3\u5316\u5408\u7269\u306e\u6cb8\u70b9\u3001\u5bc6\u5ea6\u3001\u5c48\u6298\u7387\u3092\u63a8\u7b97\u3002\u30b7\u30b9\u3001\u30c8\u30e9\u30f3\u30b9\u52b9\u679c\u3092\u52a0\u5473\u3002<\/p>\n\n\n\n<p>Group Contribution-Additivity and Quantum Mechanical Models for Predicting the Molar Refractions, Indices of Refraction, and Boiling Point of Fluorochemicals<br>J. Phys. Chem. 1995,99,P13909-13916<br>Thao D.Le and Jeffry G. Weers<br>PM3\u306e\u8a08\u7b97\u306b\u3088\u308a\u5f97\u3089\u308c\u305fPolarizability\u306e\u5024\u3092\u7528\u3044\u3066\u542b\u30d5\u30c3\u7d20\u5316\u5408\u7269\u306e\u5c48\u6298\u7387\u3001\u6cb8\u70b9\u3092\u63a8\u7b97\u3002<\/p>\n\n\n\n<p>Spectral Moments od the Edge-Adjacency Matrix of Molecular Graphs. 2. Molecules Containing Heteroatoms and QSAR Applications<br>J. Chem. Inf. Comput. Sci. 1997, 37, P320-328<br>Ernesto Estrada<br>\u30b0\u30e9\u30d5\u7406\u8ad6\u3092\u7528\u3044\u3066\u3001\uff15\uff18\u500b\u306e\u30a2\u30eb\u30ad\u30eb\u30a2\u30e9\u30a4\u30c9\u5316\u5408\u7269\u306e\u6cb8\u70b9\u3092\u63a8\u7b97\u3002<br>Spectral Moments od the Edge-Adjacency Matrix of Molecular Graphs. 3. Molecules Containing Cycles<br>J. Chem. Inf. Comput. Sci. 1998, 38, P23-27<br>Ernesto Estrada<br>80\u500b\u306e\u74b0\u72b6\u5316\u5408\u7269\u306e\u6cb8\u70b9\u3092\u63a8\u7b97\u3002<\/p>\n\n\n\n<p>The Detour Matrix in Chemistry<br>J. Chem. Inf. Comput. Sci. 1997, 37, P631-638<br>Nenad Trinajstic, Sonja Nikolic, and Bono Lucic<br>Detour\u30de\u30c8\u30ea\u30c3\u30af\u30b9\u6cd5\u3068Wiener\u3089\u306e\u65b9\u6cd5\u309276\u306e\u30a2\u30eb\u30ab\u30f3\u3001\u30b7\u30af\u30ed\u30a2\u30eb\u30ab\u30f3\u5316\u5408\u7269\u3067\u6bd4\u8f03\u3002<\/p>\n\n\n\n<p>Approach to Estimation and Prediction for Normal Boiling Point(NBP) of Alkanes Based on Novel Molecular Distance-Edge (MDE) Vector, \u03bb<br>J. Chem. Inf. Comput. Sci. 1998, 38, P387-394<br>Shushen Liu, Chenzhong Cao, and Zhiliang Li<br>\u5206\u5b50\u4e2d\u306e\u7aef\uff08Edge\uff09\u306e\u8ddd\u96e2\u3092\u7528\u3044\u3066\u5206\u5b50\u306e\u6cb8\u70b9\u3092\u63a8\u7b97\u3002<\/p>\n\n\n\n<p>Design of Topological Indices. Part 10. Parameters Based on Electronegativity and Covalent Radius for the Computation of Molecular Graph Descriptors for Heteroatom-Containing Molecules<br>J. Chem. Inf. Comput. Sci. 1998, 38, P395-401<br>Ovidiu Ivanciuc,Teodora Ivanciuc, and Alexandru T. Balaban<br>\u9178\u7d20\u3084\u786b\u9ec4\u306a\u3069\u306e\u539f\u5b50\u3092\u542b\u3080185\u5316\u5408\u7269\u306b\u3064\u3044\u3066\u30b0\u30e9\u30d5\u7406\u8ad6\u3092\u5fdc\u7528\u3057\u3066\u6cb8\u70b9\u3092\u63a8\u7b97\u3002<\/p>\n\n\n\n<p>Extension of Edge Connectivity Index. Relationships to Line Graph Indices and QSAR Applications<br>J. Chem. Inf. Comput. Sci. 1998, 38, P428-431<br>Ernesto Estrada, Nicolais Guevara, and Ivan Gutman<br>\u5206\u5b50\u4e2d\u306e\u7aef\uff08Edge\uff09\u306e\u7d50\u5408\u6307\u6a19\u3092\u7528\u3044\u3066\u6cb8\u70b9\u3092\u306f\u3058\u3081\u3068\u3059\u308b\uff18\u3064\u306e\u7269\u6027\u3092\u63a8\u7b97\u3002<\/p>\n\n\n\n<p>Polarity-Numbers of Cycle-Containing Structures<br>J. Chem. Inf. Comput. Sci. 1998, 38, P715-719<br>Istvan Lukovits and Wolfgang Linert<br>Wiener\u3089\u306b\u3088\u3063\u3066\u63d0\u6848\u3055\u308c\u305f\u30dd\u30fc\u30e9\u30ea\u30c6\u30a3\u30fc\u6570\u3092\u6539\u826f\u3057\u3001\u70ad\u5316\u6c34\u7d20\u5316\u5408\u7269\u306e\u6cb8\u70b9\u3092\u63a8\u7b97\u3002<\/p>\n\n\n\n<p>Correlation of Boiling Points with Molecular Structure for Chlorofluoroethanes<br>J. Chem. Inf. Comput. Sci. 1998, 38, P715-719<br>Terry S. Carlton<br>52\u306eChlorofluoroethane\u5316\u5408\u7269\u306b\u5bfe\u3057\uff16\u3064\u306e\u6307\u6a19\u3092\u7528\u3044\u3066\u6cb8\u70b9\u3092\u63a8\u7b97\u3002\u300d<\/p>\n\n\n\n<hr class=\"wp-block-separator has-alpha-channel-opacity\"\/>\n\n\n\n<p>Copyright pirika.com since 1999-<br>Mail: yamahiro<mark style=\"background-color:rgba(0, 0, 0, 0)\" class=\"has-inline-color has-bright-red-color\">X<\/mark>pirika.com (<mark style=\"background-color:rgba(0, 0, 0, 0)\" class=\"has-inline-color has-bright-red-color\">X<\/mark>\u3092@\u306b\u7f6e\u304d\u63db\u3048\u3066\u304f\u3060\u3055\u3044) <br>\u30e1\u30fc\u30eb\u306e\u4ef6\u540d\u306f[pirika]\u3067\u59cb\u3081\u3066\u304f\u3060\u3055\u3044\u3002<\/p>\n\n\n\n<p><\/p>\n","protected":false},"excerpt":{"rendered":"<p>2025.11.45 pirika.com\u3067\u5316\u5b66 &gt;\u30c1\u30e3\u30d4\u30a8\u30e2\u30f3-3rd Pirika Origin (CPO)&gt; \u30cf\u30f3\u30bb\u30f3\u6eb6\u89e3\u5ea6\u30d1\u30e9\u30e1\u30fc\u30bf (HSP)&gt; \u5316\u5b66\u5168\u822c &gt; \u60c5\u5831\u5316\u5b66 \u3000&gt;\u7269\u6027\u5316 &hellip; <a href=\"https:\/\/www.pirika.com\/wp\/chemistry-at-pirika-com\/chemistry\/tcpe\/bp-theory\" class=\"more-link\"><span class=\"screen-reader-text\">&#8220;\u6cb8\u70b9\u306e\u63a8\u7b97\u6cd5\u3068\u8a08\u7b97\u30a2\u30d7\u30ec\u30c3\u30c8&#8221; \u306e<\/span>\u7d9a\u304d\u3092\u8aad\u3080<\/a><\/p>\n","protected":false},"author":1,"featured_media":0,"parent":417,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"_locale":"ja","_original_post":"https:\/\/www.pirika.com\/wp\/%e6%b2%b8%e7%82%b9%e3%81%ae%e6%8e%a8%e7%ae%97%e6%b3%95","footnotes":""},"class_list":["post-4268","page","type-page","status-publish","hentry","ja"],"jetpack_sharing_enabled":true,"_links":{"self":[{"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/pages\/4268","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/comments?post=4268"}],"version-history":[{"count":23,"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/pages\/4268\/revisions"}],"predecessor-version":[{"id":14129,"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/pages\/4268\/revisions\/14129"}],"up":[{"embeddable":true,"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/pages\/417"}],"wp:attachment":[{"href":"https:\/\/www.pirika.com\/wp\/wp-json\/wp\/v2\/media?parent=4268"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}