Octyl-phosphonic acid bis-((1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl) ester | 632366-46-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: Octyl-phosphonic acid bis-((1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl) ester
• 英文别名: (1S,2R,4R)-4-methyl-2-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-octyl-oxidophosphaniumyl]oxy-1-propan-2-ylcyclohexane
• CAS: 632366-46-2
• 化学式: C₂₈H₅₅O₃P
• 分子量: 470.717
• InChiKey: BRBBGWKAYXYWQV-BNNSEFEDSA-N

物化性质

• 沸点：
  528.4±17.0 °C(Predicted)
• 密度：
  0.95±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  9.8
• 重原子数：
  32
• 可旋转键数：
  13
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  41.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  溴甲苯 、 Octyl-phosphonic acid bis-((1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl) ester 在 仲丁基锂 作用下， 以65%的产率得到
  参考文献：
  名称：

  Radical addition reactions of chiral phosphorus hydrides

  摘要：

  Intermolecular radical addition of a (1R,2R,3S,5R)-(-)-pinanediol-derived thiophosphite leads to the diastereoselective formation of organophosphorus adducts. Addition of the intermediate phosphonothioyl radical to electron-rich alkenes or alkynes occurs with retention of configuration at phosphorus. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2003.04.001
• 作为产物：
  描述：

  O,O-dimenthyl thiophosphite 在 三乙基硼 、 间氯过氧苯甲酸 作用下， 以 环己烷 为溶剂， 生成 Octyl-phosphonic acid bis-((1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl) ester
  参考文献：
  名称：

  Radical addition reactions of chiral phosphorus hydrides

  摘要：

  Intermolecular radical addition of a (1R,2R,3S,5R)-(-)-pinanediol-derived thiophosphite leads to the diastereoselective formation of organophosphorus adducts. Addition of the intermediate phosphonothioyl radical to electron-rich alkenes or alkynes occurs with retention of configuration at phosphorus. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2003.04.001

文献信息

• Radical addition reactions of chiral phosphorus hydrides
  作者：Christopher M. Jessop、Andrew F. Parsons、Anne Routledge、Derek J. Irvine

  DOI：10.1016/j.tetasy.2003.04.001

  日期：2003.10

  Intermolecular radical addition of a (1R,2R,3S,5R)-(-)-pinanediol-derived thiophosphite leads to the diastereoselective formation of organophosphorus adducts. Addition of the intermediate phosphonothioyl radical to electron-rich alkenes or alkynes occurs with retention of configuration at phosphorus. (C) 2003 Elsevier Ltd. All rights reserved.