N'-Hexyl-N,N-dimethyl-formamidine | 85599-94-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N'-Hexyl-N,N-dimethyl-formamidine
• 英文别名: N'-hexyl-N,N-dimethylmethanimidamide
• CAS: 85599-94-6；125033-87-6
• 化学式: C₉H₂₀N₂
• 分子量: 156.271
• InChiKey: LCVLTKREKPKYOA-KTKRTIGZSA-N

物化性质

• 沸点：
  209.2±23.0 °C(Predicted)
• 密度：
  0.82±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.16
• 重原子数：
  11.0
• 可旋转键数：
  6.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  15.6
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为产物：
  描述：

  N-己基甲酰胺 在 sodium hydroxide 、 potassium carbonate 作用下， 以 乙醚 、 甲苯 为溶剂， 反应 6.0h， 生成 N'-Hexyl-N,N-dimethyl-formamidine
  参考文献：
  名称：

  Eine einfache Synthese fürN,N,N′-trisubstituierte Amidine

  摘要：

  DOI：

  10.1055/s-1983-30211

文献信息

• Benzamidines, alkamidines and formamidines formed by use of aryl- and alkyliminodimagnesium: Molar ratio and structure of reagent governing the reaction
  作者：Masao Okubo、Yasumasa Omote

  DOI：10.1002/(sici)1099-1395(199604)9:4<212::aid-poc775>3.0.co;2-a

  日期：1996.4

  In order to extend the the method for preparation of amidines using N-Mg reagents, aryl- and alkyliminodimagnesium [IDMg, ArN(MgBr)(2) and RN(MgBr)(2)] were reacted with esters, amides, ortho- esters, acetals, aminoacetal and arene- and alkane carbonitriles, Among the compounds used, aminoacetal and carbonitriles were proved to be useful as starting materials for amidine preparation; alkyl-IDMgs were successfully used for the first time, It was noted that an excess molar amount of IDMg is needed in the reported reaction of ArN(MgBr), with benzonitrile (aryl-aryl combination), whereas no excess is needed in aryl-alkyl, alkyl-aryl, and alkyl-alkyl combinations of reagent and substrate, From the viewpoint previously proposed in terms of relative efficiency of single electron transfer in the reactions of magnesium reagents, the most probable reason for the difference in the need for an excess molar amount of aryl and alkyl IDMg was ascribed to the difference in the electron-donating abilities of reagents, Additional minor reasons are discussed.