4,6-di(t-butyl)-2-(diphenylphosphinoyloxy)-4-methylaniline | 1234421-95-4

• 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: 4,6-di(t-butyl)-2-(diphenylphosphinoyloxy)-4-methylaniline
• 英文别名: 2,4-Ditert-butyl-6-diphenylphosphoryloxyaniline；2,4-ditert-butyl-6-diphenylphosphoryloxyaniline
• CAS: 1234421-95-4
• 化学式: C₂₆H₃₂NO₂P
• 分子量: 421.519
• InChiKey: RWXVFQHHWXKDEZ-UHFFFAOYSA-N

物化性质

• 沸点：
  518.1±60.0 °C(Predicted)
• 密度：
  1.12±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  52.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2,4-di-tert-butylnitrobenzene 、 Diphenylphosphine oxide 在 dirhodium tetraacetate 作用下， 以 甲苯 为溶剂， 反应 7.0h， 以71%的产率得到4,6-di(t-butyl)-2-(diphenylphosphinoyloxy)-4-methylaniline
  参考文献：
  名称：

  Synthesis of o-(diphenylphosphinoyloxy)anilines by the rhodium-catalyzed reaction of nitroarenes and diphenylphosphine oxide

  摘要：

  A rhodium complex Rh(2)(OAc)(4) catalyzed the reaction of nitrobenzenes and diphenylphosphine oxide HP(=O)Ph(2) giving o-(diphenylphosphinoyloxy)anilines predominantly, which were accompanied by small amounts of the p-isomers. Nitorobenzenes possessing a bulky o-substituent, particularly o-(t-butyl)nitrobenzenes, underwent the reaction in high yields. The reaction is considered to involve the reductive formation of O-phosphinoyl-N-arylhydroxyamines from nitrobenzenes, and o-phosphinoyloxylation by the rearrangement. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.04.029

文献信息

• Synthesis of o-(diphenylphosphinoyloxy)anilines by the rhodium-catalyzed reaction of nitroarenes and diphenylphosphine oxide
  作者：Mieko Arisawa、Manabu Kuwajima、Masahiko Yamaguchi

  DOI：10.1016/j.tetlet.2010.04.029

  日期：2010.6

  A rhodium complex Rh(2)(OAc)(4) catalyzed the reaction of nitrobenzenes and diphenylphosphine oxide HP(=O)Ph(2) giving o-(diphenylphosphinoyloxy)anilines predominantly, which were accompanied by small amounts of the p-isomers. Nitorobenzenes possessing a bulky o-substituent, particularly o-(t-butyl)nitrobenzenes, underwent the reaction in high yields. The reaction is considered to involve the reductive formation of O-phosphinoyl-N-arylhydroxyamines from nitrobenzenes, and o-phosphinoyloxylation by the rearrangement. (C) 2010 Elsevier Ltd. All rights reserved.