(1,1,5-trihydrooctafluoropentyl) methylphosphinate | 1235819-13-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (1,1,5-trihydrooctafluoropentyl) methylphosphinate
• CAS: 1235819-13-2
• 化学式: C₆H₇F₈O₂P
• 分子量: 294.081
• InChiKey: ZMROIQBZOMGDAB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.28
• 重原子数：
  17.0
• 可旋转键数：
  6.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  26.3
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  水合氯醛 、 (1,1,5-trihydrooctafluoropentyl) methylphosphinate 以 苯 为溶剂， 反应 8.0h， 以3.1 g的产率得到(1-hydroxy-2,2,2-trichloroethyl)methylphosphinic acid
  参考文献：
  名称：

  Polyfluoroalloxy phosphonic and phosphinic acid derivatives: I. 1-Hydroxy-2,2,2-trichloroethylphosphinates

  摘要：

  Polyfluoroalkyl esters of 1-hydroxy-2,2,2-trichloroethylphosphonic and aryl(alkyl-)phosphinic acids exhibited antienzyme activity towards esterases of animal and microbial origin. A good correlation is observed between high antiesterase activity of the target compounds and their physicochemical parameters, characterizing their structure.

  DOI：

  10.1134/s1070363210030096
• 作为产物：
  描述：

  Ethyl-bis(2,2,3,3,4,4,5,5-octafluoropentoxy)phosphane 反应 0.5h， 生成 (1,1,5-trihydrooctafluoropentyl) methylphosphinate
  参考文献：
  名称：

  Polyfluoroalloxy phosphonic and phosphinic acid derivatives: I. 1-Hydroxy-2,2,2-trichloroethylphosphinates

  摘要：

  Polyfluoroalkyl esters of 1-hydroxy-2,2,2-trichloroethylphosphonic and aryl(alkyl-)phosphinic acids exhibited antienzyme activity towards esterases of animal and microbial origin. A good correlation is observed between high antiesterase activity of the target compounds and their physicochemical parameters, characterizing their structure.

  DOI：

  10.1134/s1070363210030096