{"id":49708,"date":"2024-06-11T18:28:32","date_gmt":"2024-06-11T10:28:32","guid":{"rendered":"http:\/\/www.newtopchem.com\/archives\/49708"},"modified":"2024-06-11T18:28:32","modified_gmt":"2024-06-11T10:28:32","slug":"phenyltrimethylammonium-iodide","status":"publish","type":"post","link":"http:\/\/www.newtopchem.com\/archives\/49708","title":{"rendered":"Phenyltrimethylammonium iodide","gt_translate_keys":[{"key":"rendered","format":"text"}]},"content":{"rendered":"<p><img decoding=\"async\" loading=\"lazy\" class=\"alignnone size-full wp-image-49707\" src=\"http:\/\/www.newtopchem.com\/wp-content\/uploads\/2024\/06\/610622fb28f84705a330df341812e182.gif\" width=\"283\" height=\"227\" alt=\"Phenyltrimethylammonium iodide structural formula\" \/><\/p>\n<p>Structural formula<\/p>\n<table class=\"summary-table table table-striped table-bordered\">\n<col width=\"90\" \/>\n<tbody>\n<tr>\n<th scope=\"row\">Business number<\/th>\n<td>02D5<\/td>\n<\/tr>\n<tr>\n<th scope=\"row\">Molecular formula<\/th>\n<td>C9H14IN<\/td>\n<\/tr>\n<tr>\n<th scope=\"row\">Molecular weight<\/th>\n<td>263.12<\/td>\n<\/tr>\n<tr>\n<th scope=\"row\">label<\/th>\n<td>\n<p>                         Trimethylphenylammonium iodide,<\/p>\n<p>                         Phenyltrimethylamine iodide,<\/p>\n<p>                         (CH3)3N(I)C6H5,<\/p>\n<p>                         N,n,n-trimethylaniliniumiodide,<\/p>\n<p>                         N,n,n-trimethyl-benzenaminiuiodide,<\/p>\n<p>                         N,n,n-trimethylbenzenaminiiumiodide,<\/p>\n<p>                         N,n-dimethylanilinemethiodide,<\/p>\n<p>                         Phenyltrimethyl-ammoniodide,<\/p>\n<p>                         Trimethylanilliniumiodide,<\/p>\n<p>                         Trimethylphenyl-ammoniuiodide,<\/p>\n<p>                         Phenyltrimethylammonium iodide<\/p>\n<\/td>\n<\/tr>\n<\/tbody>\n<\/table>\n<ul class=\"nav nav-tabs\">\n<li class=\"active\"><a href=\"#bh\">Numbering system<\/a><\/li>\n<li><a href=\"#wx\">Physical property data<\/a><\/li>\n<li><a href=\"#dl\">Toxicological data<\/a><\/li>\n<li><a href=\"#st\">Ecological data<\/a><\/li>\n<li><a href=\"#fz\">Molecular structure data<\/a><\/li>\n<li><a href=\"#js\">Computing chemical data<\/a><\/li>\n<li class=\"dropdown pull-right\">\n                     <a href=\"\" class=\"dropdown-toggle\">More <span class=\"caret\"><\/span><\/a><\/p>\n<ul class=\"dropdown-menu\" role=\"menu\">\n<li><a href=\"#xz\">Properties and Stability<\/a><\/li>\n<li><a href=\"#zc\">Storage method<\/a><\/li>\n<li><a href=\"#hc\">Synthesis method<\/a><\/li>\n<li><a href=\"#yt\">Purpose<\/a><\/li>\n<\/ul>\n<\/li>\n<\/ul>\n<h2 id=\"bh\">Numbering system<\/h2>\n<p><b>CAS number:<\/b>98-04-4<\/p>\n<p><b>MDL number:<\/b>MFCD00011791<\/p>\n<p><b>EINECS number:<\/b>202-630-3<\/p>\n<p><b>RTECS number:<\/b>BT2450000<\/p>\n<p><b>BRN number:<\/b>3916752<\/p>\n<p><b>PubChem number:<\/b>24849650<\/p>\n<h2 id=\"wx\">Physical property data<\/h2>\n<p>\n     <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>1.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Appearance: white powder.  <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>2.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Density (<SPAN>g\/mL,25<\/SPAN><\/SPAN><SPAN>\u2103<\/SPAN><SPAN>): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>3.<SPAN> <\/SPAN><\/SPAN><\/SPAN><SPAN>Relative vapor density (  <SPAN>g\/mL,<\/SPAN>Air <SPAN>=1<\/SPAN>): Undetermined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>4.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Melting point (<SPAN>\u00baC<\/SPAN>): <\/SPAN><SPAN>227<\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>5.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Boiling point (<SPAN>\u00baC,<\/SPAN>normal pressure): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>6.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Boiling point (<SPAN>\u00baC, kPa<\/SPAN>): Not determined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>7.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Refractive index: Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>8.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Flashpoint (<SPAN>\u00baC<\/SPAN>): Undetermined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>9.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Specific optical rotation (<SPAN>\u00ba<\/SPAN>): Undetermined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>10.<SPAN> <\/SPAN><\/SPAN><\/SPAN><SPAN>Autoignition point or ignition temperature (<SPAN>\u00baC<\/SPAN>\uff09<SPAN>:<\/SPAN><\/SPAN><SPAN> <\/SPAN><SPAN>Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>11.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Vapor pressure (<SPAN>mmHg, 55\u00baC<\/SPAN>): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>12.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Saturated vapor pressure (<SPAN>kPa, 25 \u00baC<\/SPAN>): Not determined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>13.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Heat of combustion (<SPAN>KJ\/mol<\/SPAN>): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>14.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Critical temperature (<SPAN>\u00baC<\/SPAN>): Undetermined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>15.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Critical pressure (<SPAN>KPa<\/SPAN>): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>16.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Oil and water (octanol<SPAN>\/<\/SPAN>Log value of the partition coefficient (water): undetermined <SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN>17.<SPAN> <\/SPAN><\/SPAN><\/SPAN><SPAN>Explosion upper limit (<SPAN>%,V\/V<\/SPAN>): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>18.<SPAN> <\/SPAN>  <\/SPAN><\/SPAN><SPAN>Lower explosion limit (<SPAN>%,V\/V<\/SPAN>): Undetermined<SPAN><\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>19.<SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Solubility: Undetermined<\/SPAN><SPAN><\/SPAN><\/P>\n     <\/p>\n<h2 id=\"dl\">Toxicological data<\/h2>\n<p>\n     <SPAN>Acute toxicity: <SPAN>Mouse peritoneal cavity <SPAN>LD50<\/SPAN>: <SPAN>55mg\/kg<\/SPAN>;<\/SPAN><\/SPAN><br \/>\n <SPAN><SPAN>  -US; mso-fareast-language: ZH-CN; mso-bidi-language: AR-SA&#8221;&gt;Mouse subcutaneous <SPAN>LD50<\/SPAN>: <SPAN>85mg  \/kg<\/SPAN>;<\/SPAN><\/SPAN><\/SPAN><br \/>\n <SPAN><SPAN><SPAN>\u200a\u200a<SPAN>Mouse<\/SPAN><SPAN>Intravenous injection<\/SPAN><SPAN>LD50<\/SPAN><SPAN>\uff1a<\/SPAN><SPAN>5620<\/SPAN><SPAN>\u03bc<\/SPAN><SPAN>g\/kg<\/SPAN><SPAN>;<\/SPAN><\/SPAN><\/SPAN><\/SPAN>\n     <\/p>\n<h2 id=\"st\">Ecological data<\/h2>\n<p>\n     <P class=\"MsoNormal\" align=\"left\"><SPAN>This substance is slightly harmful to water.  <SPAN><\/SPAN><\/SPAN><\/P>\n     <\/p>\n<h2 id=\"fz\">Molecular structure data<\/h2>\n<p>\n     None\n     <\/p>\n<h2 id=\"js\">Compute chemical data<\/h2>\n<p>\n     <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>1. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Reference value for hydrophobic parameter calculation (<SPAN>XlogP<\/SPAN>):<\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>2. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Number of hydrogen bond donors: <SPAN>0<\/SPAN><\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>3. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Number of hydrogen bond acceptors: <SPAN>1<\/SPAN><\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>4. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Number of rotatable chemical bonds: <SPAN>1<\/SPAN><\/SPAN>  <SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>5. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Number of tautomers:<\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>6. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Topological molecular polar surface area (<SPAN>TPSA<\/SPAN>):<SPAN>0<\/SPAN><\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>7. <SPAN> <\/SPAN><\/SPAN><\/SPAN><SPAN>Number of heavy atoms: <SPAN>11<\/SPAN><\/SPAN><SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>8. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Surface charge: <SPAN>0<\/SPAN><\/SPAN><SPAN>  <\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>9. <SPAN> <\/SPAN><\/SPAN><\/SPAN>  <SPAN>Complexity: <SPAN>95.8<\/SPAN><\/SPAN><SPAN>  <\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>10. <\/SPAN><\/SPAN><SPAN>Number of isotope atoms: <SPAN>0<\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>11. <\/SPAN><\/SPAN><SPAN>Determine the number of atomic stereocenters: <SPAN>0<\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>12. <\/SPAN><\/SPAN><SPAN>The number of uncertain atomic stereocenters: <SPAN>0<\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>13. <\/SPAN><\/SPAN><SPAN>Determine the number of stereocenters of chemical bonds: <SPAN>0<\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>14. <\/SPAN><\/SPAN><SPAN>Uncertain number of chemical bond stereocenters: <SPAN>0<\/SPAN><\/SPAN><\/P><br \/>\n <P class=\"MsoNormal\" align=\"left\"><SPAN><SPAN>15. <\/SPAN><\/SPAN><SPAN>Covalent bond unit\ufffdQuantity: <SPAN>2<\/SPAN><\/SPAN><\/P>\n     <\/p>\n<h2 id=\"xz\">Properties and stability<\/h2>\n<p>\n     <P class=\"MsoNormal\" align=\"left\"><SPAN>Avoid contact with oxidants and light.  <SPAN><\/SPAN><\/SPAN><\/P>\n     <\/p>\n<h2 id=\"zc\">Storage method<\/h2>\n<p>\n     <SPAN>Stored in a cool, ventilated warehouse.  Keep away from fire and heat sources.  should be kept away from oxidizer, do not store together.  Store in dark place.  Use explosion-proof lighting and ventilation facilities.  Do not use sparks easily<\/SPAN><br \/>\n <SPAN>machinery, equipment and tools.  The storage area should be equipped with emergency release equipment and suitable containment materials.  <SPAN><\/SPAN><\/SPAN>\n     <\/p>\n<h2 id=\"hc\">Synthesis method<\/h2>\n<p>\n     None\n     <\/p>\n<h2 id=\"yt\">Purpose<\/h2>\n<p>\n     None\n     <\/p>\n<p>     extended-reading:<a href=\"https:\/\/www.newtopchem.com\/archives\/830\">https:\/\/www.newtopchem.com\/archives\/830<\/a><\/br>extended-reading:<a href=\"https:\/\/www.newtopchem.com\/archives\/933\">https:\/\/www.newtopchem.com\/archives\/933<\/a><\/br>extended-reading:<a href=\"https:\/\/www.bdmaee.net\/polyurethane-rigid-foam-catalyst-cas15875-13-5-jeffcat-tr-90\/\">https:\/\/www.bdmaee.net\/polyurethane-rigid-foam-catalyst-cas15875-13-5-jeffcat-tr-90\/<\/a><\/br>extended-reading:<a href=\"https:\/\/www.newtopchem.com\/archives\/40263\">https:\/\/www.newtopchem.com\/archives\/40263<\/a><\/br>extended-reading:<a href=\"https:\/\/www.newtopchem.com\/archives\/683\">https:\/\/www.newtopchem.com\/archives\/683<\/a><\/br>extended-reading:<a href=\"https:\/\/www.bdmaee.net\/dioctyltin-dilaurate-dotdl\/\">https:\/\/www.bdmaee.net\/dioctyltin-dilaurate-dotdl\/<\/a><\/br>extended-reading:<a href=\"https:\/\/www.newtopchem.com\/archives\/44045\">https:\/\/www.newtopchem.com\/archives\/44045<\/a><\/br>extended-reading:<a href=\"https:\/\/www.bdmaee.net\/n-formylmorpholine-cas4394-85-8-4-formylmorpholine\/\">https:\/\/www.bdmaee.net\/n-formylmorpholine-cas4394-85-8-4-formylmorpholine\/<\/a><\/br>extended-reading:<a href=\"https:\/\/www.bdmaee.net\/low-odor-catalyst-9727\/\">https:\/\/www.bdmaee.net\/low-odor-catalyst-9727\/<\/a><\/br>extended-reading:<a href=\"https:\/\/www.bdmaee.net\/2-4-6-trisdimethylaminomethylphenol\/\">https:\/\/www.bdmaee.net\/2-4-6-trisdimethylaminomethylphenol\/<\/a><\/p>\n","protected":false,"gt_translate_keys":[{"key":"rendered","format":"html"}]},"excerpt":{"rendered":"<p>Structural formula Business number 02D5 Molecular formu&#8230;<\/p>\n","protected":false,"gt_translate_keys":[{"key":"rendered","format":"html"}]},"author":1,"featured_media":49707,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":[],"categories":[6],"tags":[15530],"gt_translate_keys":[{"key":"link","format":"url"}],"_links":{"self":[{"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/posts\/49708"}],"collection":[{"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/comments?post=49708"}],"version-history":[{"count":0,"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/posts\/49708\/revisions"}],"wp:featuredmedia":[{"embeddable":true,"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/media\/49707"}],"wp:attachment":[{"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/media?parent=49708"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/categories?post=49708"},{"taxonomy":"post_tag","embeddable":true,"href":"http:\/\/www.newtopchem.com\/wp-json\/wp\/v2\/tags?post=49708"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}