5H-dibenz 10,11-dihydroazepine-5-N-methyl carboxamide | 134386-26-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯氮卓类
• 英文名称: 5H-dibenz 10,11-dihydroazepine-5-N-methyl carboxamide
• 英文别名: 10,11-Dihydro-dibenzo[b,f]azepine-5-carboxylic acid methylamide；N-methyl-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
• CAS: 134386-26-8
• 化学式: C₁₆H₁₆N₂O
• 分子量: 252.316
• InChiKey: RBZYGXWEIAEBHN-UHFFFAOYSA-N

物化性质

• 溶解度：
  >37.8 [ug/mL]

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  19
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  32.3
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  亚氨基二苄 、 氨基甲酸乙酯 在 三氯氧磷 作用下， 以37%的产率得到5H-dibenz 10,11-dihydroazepine-5-N-methyl carboxamide
  参考文献：
  名称：

  Contra-thermodynamic trans-esteripication of carbamates by counter-attack strategy: A viable non-phosgene, non-mic route to carbamate pesticides

  摘要：

  Treatment of methyl N-methylcarbamate (1, R= Me) with phosphorus oxychloride and 1-naphthol results in the formation of the transesterified product, 1-naphthyl N-methylcarbamate (2, Ar = 1 -naphthyl) in good yield. Similarly, ethyl N-methylthiocarbamate (5) is converted to 1-naphthyl N-methylcarbamate (2, Ar = 1-naphthyl) on treatment with phosphorus oxychloride and 1-naphthol. The mechanism of these interesting and industrially important transformations is discussed.

  DOI：

  10.1016/s0040-4020(01)86381-x

文献信息

• Contra-thermodynamic trans-esteripication of carbamates by counter-attack strategy: A viable non-phosgene, non-mic route to carbamate pesticides
  作者：G.H. Kulkarni、R.H. Naik、S.K. Tandel、S. Rajappa

  DOI：10.1016/s0040-4020(01)86381-x

  日期：1991.1

  Treatment of methyl N-methylcarbamate (1, R= Me) with phosphorus oxychloride and 1-naphthol results in the formation of the transesterified product, 1-naphthyl N-methylcarbamate (2, Ar = 1 -naphthyl) in good yield. Similarly, ethyl N-methylthiocarbamate (5) is converted to 1-naphthyl N-methylcarbamate (2, Ar = 1-naphthyl) on treatment with phosphorus oxychloride and 1-naphthol. The mechanism of these interesting and industrially important transformations is discussed.