Tricyclohexylstannyl 2-(2,3-dimethylanilino)benzoate | 193674-09-8

• 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: Tricyclohexylstannyl 2-(2,3-dimethylanilino)benzoate
• CAS: 193674-09-8
• 化学式: C₃₃H₄₇NO₂Sn
• 分子量: 608.452
• InChiKey: UEHHDTLDHCCLOL-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  10.15
• 重原子数：
  37
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  [Ag(mefenamato)]n 、 三环己基氯化锡 以 氯仿 为溶剂， 以70%的产率得到Tricyclohexylstannyl 2-(2,3-dimethylanilino)benzoate
  参考文献：
  名称：

  ¹H,¹³C,¹¹⁹Sn NMR,^119mSn Mössbauer, Infrared and Mass Spectrometric Studies of Organotin Carboxylates of 2-(2,3-dimethylphenyl)Aminobenzoic Acid and their Effect on Microorganisms.

  摘要：

  The synthesis of a new series of organotin carboxylates of 2-(2,3-dimethylphenyl)aminobenzoic acid is reported. Multinuclear NMR (H-1, C-13, Sn-119) data have been used as a tool for determining their structures in non-coordinating solvents. Solid state structures have been proposed on the basis of IR and Mossbauer parameters. 2D NMR has been used for the assignments of high-spin systems. Screening tests of these compounds showed that they are highly active against bacteria and fungi.

  DOI：

  10.1080/00945719708000234