ethyl 4,5,6,7,8-pentafluoro-1-(4-methoxyphenyl)-4,4-diphenyl-1,4-dihydro-4l5-benzo[e][1,2,4]diazaphosphinine-3-carboxylate | 1156538-63-4

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: ethyl 4,5,6,7,8-pentafluoro-1-(4-methoxyphenyl)-4,4-diphenyl-1,4-dihydro-4l5-benzo[e][1,2,4]diazaphosphinine-3-carboxylate
• CAS: 1156538-63-4
• 化学式: C₂₉H₂₂F₅N₂O₃P
• 分子量: 572.471
• InChiKey: ZGVFCOAGWUKKES-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.99
• 重原子数：
  40.0
• 可旋转键数：
  6.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  51.13
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  ethyl 4,5,6,7,8-pentafluoro-1-(4-methoxyphenyl)-4,4-diphenyl-1,4-dihydro-4l5-benzo[e][1,2,4]diazaphosphinine-3-carboxylate 在 水 作用下， 以 乙醚 为溶剂， 反应 24.0h， 以2.2 g的产率得到[2,3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenyl]diphenylphosphine oxide
  参考文献：
  名称：

  Synthesis and molecular structure of [2,3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenyl]diphenylphosphine

  摘要：

  The reaction of (pentafluorophenyl)diphenylphosphine with C-ethoxycarbonyl- (p-methoxyphenyl) nitrile imine was used to synthesize 12,3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenyl]diphenylphosphine oxide whose reduction with trichlorosilane gave [2.3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenylI diphenylphosphine. the first representative of tertiary ort.ho-arylamino-substituted arylphosphines. According to X-ray diffraction data, the principal steric characteristics of the phosphine are close to those known for triarylphosphines.

  DOI：

  10.1134/s1070363208060121
• 作为产物：
  描述：

  [(4-甲氧基苯基)肼基]氯乙酸乙酯 、 五氟苯基二苯基膦 在 三乙胺 作用下， 以 苯 为溶剂， 反应 24.0h， 生成 ethyl 4,5,6,7,8-pentafluoro-1-(4-methoxyphenyl)-4,4-diphenyl-1,4-dihydro-4l5-benzo[e][1,2,4]diazaphosphinine-3-carboxylate
  参考文献：
  名称：

  Synthesis and molecular structure of [2,3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenyl]diphenylphosphine

  摘要：

  The reaction of (pentafluorophenyl)diphenylphosphine with C-ethoxycarbonyl- (p-methoxyphenyl) nitrile imine was used to synthesize 12,3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenyl]diphenylphosphine oxide whose reduction with trichlorosilane gave [2.3,4,5-tetrafluoro-6-(p-methoxyphenylamino)phenylI diphenylphosphine. the first representative of tertiary ort.ho-arylamino-substituted arylphosphines. According to X-ray diffraction data, the principal steric characteristics of the phosphine are close to those known for triarylphosphines.

  DOI：

  10.1134/s1070363208060121