(6Sc,9Rp)-9-dimethylamino-8-phenyl-1,8-diaza-9-phosphabenzo[3,4]bicyclo[4.3.0]nonane | 1246531-71-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: (6Sc,9Rp)-9-dimethylamino-8-phenyl-1,8-diaza-9-phosphabenzo[3,4]bicyclo[4.3.0]nonane
• 英文别名: (1R,3aS)-N,N-dimethyl-2-phenyl-3,3a,4,9-tetrahydro-[1,3,2]diazaphospholo[1,5-b]isoquinolin-1-amine
• CAS: 1246531-71-4
• 化学式: C₁₈H₂₂N₃P
• 分子量: 311.367
• InChiKey: OJJRLONBEYPXMP-PGRDOPGGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  9.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  (S)-N-((1,2,3,4-tetrahydroisoquinolin-3-yl)methyl)aniline 、 三(二甲胺基)膦 以 甲苯 为溶剂， 反应 120.0h， 以40%的产率得到(6Sc,9Rp)-9-dimethylamino-8-phenyl-1,8-diaza-9-phosphabenzo[3,4]bicyclo[4.3.0]nonane
  参考文献：
  名称：

  New P-stereogenic triaminophosphines and their derivatives: synthesis, structure, conformational study, and application as chiral ligands

  摘要：

  The synthesis, structural, and conformational studies of new P-chiral triaminophosphines, which feature an indolidine and a 1,2,3,4-tetrahydroquinolidine pattern, respectively, are reported. These compounds can feature very different 3D-structures, although they both could be seen a priori as close derivatives of the previously reported 3-phenyl-1,3-diaza-2-phosphabicyclo[3.3.0]octane. The consequences for the use of such compounds and their derivatives in asymmetric metal-catalysis are discussed on the basis of preliminary results in asymmetric cobalt-catalyzed [6+2] cycloaddition. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2010.03.013

文献信息

• New P-stereogenic triaminophosphines and their derivatives: synthesis, structure, conformational study, and application as chiral ligands
  作者：Nicolas Toselli、Remy Fortrie、David Martin、Gérard Buono

  DOI：10.1016/j.tetasy.2010.03.013

  日期：2010.5

  The synthesis, structural, and conformational studies of new P-chiral triaminophosphines, which feature an indolidine and a 1,2,3,4-tetrahydroquinolidine pattern, respectively, are reported. These compounds can feature very different 3D-structures, although they both could be seen a priori as close derivatives of the previously reported 3-phenyl-1,3-diaza-2-phosphabicyclo[3.3.0]octane. The consequences for the use of such compounds and their derivatives in asymmetric metal-catalysis are discussed on the basis of preliminary results in asymmetric cobalt-catalyzed [6+2] cycloaddition. (C) 2010 Elsevier Ltd. All rights reserved.