2-氯-5-(1H-四唑-1-基)苯胺 | 926200-13-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 中文名称: 2-氯-5-(1H-四唑-1-基)苯胺
• 英文名称: 2-chloro-5-(tetrazol-1-yl)phenylamine
• 英文别名: 2-chloro-5-(1H-tetrazol-1-yl)aniline；2-chloro-5-(tetrazol-1-yl)aniline
• CAS: 926200-13-7
• 化学式: C₇H₆ClN₅
• mdl: MFCD03419507
• 分子量: 195.611
• InChiKey: REPMWWUNJMCOJV-UHFFFAOYSA-N

物化性质

• 沸点：
  391.3±52.0 °C(Predicted)
• 密度：
  1?+-.0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  69.6
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 海关编码：
  2933990090

反应信息

• 作为反应物：
  描述：

  2-氯-5-(1H-四唑-1-基)苯胺 、 对氟苯甲醛 以 苯 为溶剂， 以98%的产率得到(4-fluorobenzylidene)(2-chloro-5-(tetrazol-1-yl)phenyl)amine
  参考文献：
  名称：

  Correlation between the rates of benzylidene condensation of R-tetrazol-1-ylphenylamines and their dissociation constants

  摘要：

  Benzylidene condensation of R-tetrazol-1-ylphenylamines with 4-fluorobenzaldehyde was studied. The correlation between the logarithm of the rate constant of the condensation of 4-fluorobenzaldehyde with R-tetrazol-1-ylphenylamines and their pK (BH)+ values was found. The reaction constant rho in the Hammett equation was determined.

  DOI：

  10.1134/s1070427213040101

文献信息

• Correlation between the rates of benzylidene condensation of R-tetrazol-1-ylphenylamines and their dissociation constants
  作者：A. V. Pavlov、E. A. Veretennikov、B. M. Laskin、A. G. Egorov

  DOI：10.1134/s1070427213040101

  日期：2013.4

  Benzylidene condensation of R-tetrazol-1-ylphenylamines with 4-fluorobenzaldehyde was studied. The correlation between the logarithm of the rate constant of the condensation of 4-fluorobenzaldehyde with R-tetrazol-1-ylphenylamines and their pK (BH)+ values was found. The reaction constant rho in the Hammett equation was determined.