N-[(2-hydroxyphenyl)carbamothioyl]-3-nitrobenzamide | 53501-23-8

• 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: N-[(2-hydroxyphenyl)carbamothioyl]-3-nitrobenzamide
• CAS: 53501-23-8
• 化学式: C₁₄H₁₁N₃O₄S
• 分子量: 317.325
• InChiKey: BVGOTQKSUAAQFF-UHFFFAOYSA-N

物化性质

• 密度：
  1.519±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  139
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  间硝基苯甲酸 、 alkaline earth salt of/the/ methylsulfuric acid 在 polyethylene glycol-600 (PEG-600) 氯化亚砜 作用下， 以 二氯甲烷 为溶剂， 反应 3.0h， 生成 N-[(2-hydroxyphenyl)carbamothioyl]-3-nitrobenzamide
  参考文献：
  名称：

  Synthesis of N—Aroyl—N′—hydroxyethyl (Hydroxyphenyl) Thiourea Derivatives Under the Condition of Phase Transfer Catalysis

  摘要：

  Reaction of aminoethanol. or aminophenol with aroyl chloride and ammonium thiocyanate under the condition of solid-liquid phase transfer catalysis using polyethylene glycol-600 (PEG-600) as the catalyst yielded N-aroyl-N'-hydroxyethyl (hydroxy phenyl) thiourea derivatives.The products have been characterised on the basis of analytical and spectral(IR and 'H-NMR)data.

  DOI：

  10.1080/00397919808004862

文献信息

• Synthesis of N—Aroyl—N′—hydroxyethyl (Hydroxyphenyl) Thiourea Derivatives Under the Condition of Phase Transfer Catalysis
  作者：Taibao Wei、Youming Zhang

  DOI：10.1080/00397919808004862

  日期：1998.8

  Reaction of aminoethanol. or aminophenol with aroyl chloride and ammonium thiocyanate under the condition of solid-liquid phase transfer catalysis using polyethylene glycol-600 (PEG-600) as the catalyst yielded N-aroyl-N'-hydroxyethyl (hydroxy phenyl) thiourea derivatives.The products have been characterised on the basis of analytical and spectral(IR and 'H-NMR)data.