benzyldichloronitroacetate | 145886-78-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: benzyldichloronitroacetate
• 英文别名: benzyl 2,2-dichloro-2-nitroacetate
• CAS: 145886-78-8
• 化学式: C₉H₇Cl₂NO₄
• 分子量: 264.065
• InChiKey: FQJILAWRJNPQJT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  72.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  苯肼 、 benzyldichloronitroacetate 反应 48.0h， 以31%的产率得到N¹-benzyloxycarbonyl-N²-phenylhydrazide
  参考文献：
  名称：

  Dichloronitroacetic acid derivatives as acylating agents for primary amines, ammonia, and phenylhydrazine

  摘要：

  The corresponding carbamic acid derivatives were obtained (28-91% yields) as a result of the reaction of dichloronitroacetic acid derivatives, O2NCCl2COR, (1a-c, R = OEt, OCH2Ph, NH2) with ammonia, methylamine, benzylamine, glycine, phenylhydrazine, and aniline. The probable mechanism of the process and factors that affect the nature of the departing group were discussed.

  DOI：

  10.1007/bf00864535
• 作为产物：
  描述：

  benzylchloronitroacetate ammonium salt 在 磺酰氯 作用下， 以 乙醚 为溶剂， 以87%的产率得到benzyldichloronitroacetate
  参考文献：
  名称：

  Dichloronitroacetic acid derivatives as acylating agents for primary amines, ammonia, and phenylhydrazine

  摘要：

  The corresponding carbamic acid derivatives were obtained (28-91% yields) as a result of the reaction of dichloronitroacetic acid derivatives, O2NCCl2COR, (1a-c, R = OEt, OCH2Ph, NH2) with ammonia, methylamine, benzylamine, glycine, phenylhydrazine, and aniline. The probable mechanism of the process and factors that affect the nature of the departing group were discussed.

  DOI：

  10.1007/bf00864535