2-Chloro-4-ethoxy-6-p-tolyl-1,3,5-triazine | 80355-90-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: 2-Chloro-4-ethoxy-6-p-tolyl-1,3,5-triazine
• 英文别名: 2-Chloro-4-ethoxy-6-(4-methylphenyl)-1,3,5-triazine
• CAS: 80355-90-4
• 化学式: C₁₂H₁₂ClN₃O
• 分子量: 249.7
• InChiKey: CETTXWMJFANHFH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  47.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N,N-二甲基-4-甲基苯甲酰胺 、 N'-氰基-O-乙基异脲 在 三氯氧磷 作用下， 生成 2-Chloro-4-ethoxy-6-p-tolyl-1,3,5-triazine
  参考文献：
  名称：

  The Synthesis of Triazines fromN-Cyanocarbamimidates

  摘要：

  DOI：

  10.1055/s-1981-29645

文献信息

• TRIAZINE SYNTHESIS
  申请人：COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION

  公开号：EP0051067A1

  公开（公告）日：1982-05-12
• [EN] TRIAZINE SYNTHESIS
  申请人：——

  公开号：WO1981003020A1

  公开（公告）日：1981-10-29

  (EN) A process for the synthesis of substituted 1,3,5-triazine compounds of the general formula: (FORMULA) wherein R1 and R2, which may be the same or different, are selected from the group consisting of hydrogen, halogen, alkoxycarbonyl, alkyl, substituted alkyl, aryl, substituted aryl, heteroaryl, substituted heteroaryl, alkylamino, dialkylamino, arylamino, alkyl-arylamino, alkylthio, arylthio, alkoxy and aryloxy (provided that R1 and R2 are not both halogen); and R3 is selected from the group consisting of halogen, alkylamino, dialkylamino, arylamino, alkyl-arylamino and N-heteroaryl; comprises reaction of a substituted halomethyleneiminium salt with a substituted N-cyanoamidine, N-cyanoguanidine, N-cyanocarbamimidate or N-cyanocarbamidothioate. Substituted 1,3,5-triazine compounds having fungal germination inhibition properties are also disclosed. The following compounds 1) 2-chloro-4-phenyl-1,3,5-triazine, 2) 2-chloro-4-phenoxymethyl-6-phenyl-1,3,5-triazine, 3) 2-N-methylphenylamino-4-phenyl-1,3,5-triazin, 4) 2-chloro-4-cyanomethyl-6-phenyl-1,3,5-triazine are also disclosed and claimed. (FR) Procede de synthese de composes a base de triazine 1,3,5-substituee de formule generale suivante: (FORMULE) dans laquelle R1 et R2, qui peuvent etre identiques ou differents, sont choisis parmi le groupe consistant en hydrogene, halogene, alcoxycarbonyle, alkyle, alkyle substitue, aryle, aryle substitue, heteroaryle, heteroaryle substitue, alkylamino, dialkylamino, arylamino, alkyle-arylamino, alkylthio, arylthio, alcoxy et aryloxy (a condition que R1 et R2 ne soient pas tous les deux un halogene); et R3 est choisi parmi le groupe consistant en halogene, alkylamino, dialkylamino, arylamino, alkyle-arylamino et N-heteroaryle; procede qui comprend la reaction d"un sel d"halomethylene iminium substitue avec une N-cyano amidine substituee, une N-cyanoguanidine, une N-cyanocarbanimidate ou un N-cyanocarbamido thioate. Des composes de triazine 1,3,5-substituee possedant des proprietes d"inhibition de la germination fongique sont egalement decrits. Les composes suivant sont egalement decrits et revendiques: 1) 2-chloro-4-phenyl-1,3,5- triazine, 2) 2-chloro-4-phenoxytnethyl-6-phenyl. 1,3,5-triazine; 3) 2-N-methylphenylamino-4-phenyl-1,3,5-triazine; 4) 2-chloro-4-cyanomethyle-6-phenyl-1,3,5-triazine.
• The Synthesis of Triazines from<i>N</i>-Cyanocarbamimidates
  作者：Roger L. N. Harris

  DOI：10.1055/s-1981-29645

  日期：——