[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-[(E)-1-diethoxyphosphorylprop-1-en-2-yl]iminocarbamate | 718614-87-0

• 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: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-[(E)-1-diethoxyphosphorylprop-1-en-2-yl]iminocarbamate
• CAS: 718614-87-0
• 化学式: C₁₈H₃₃N₂O₅P
• 分子量: 388.444
• InChiKey: BWJXQXBCWAVWDY-ZVORJXGDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  26
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  86.6
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  L-叔亮氨醇 、 [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-[(E)-1-diethoxyphosphorylprop-1-en-2-yl]iminocarbamate 以 二氯甲烷 为溶剂， 以91%的产率得到
  参考文献：
  名称：

  Addition of amine derivatives to phosphorylated 1,2-diaza-1,3-butadienes. Synthesis of α-aminophosphonates

  摘要：

  Achiral and chiral 1,2-diaza-1,3-butadienes derived from phosphine oxides and phosphonates are obtained from hydrazonoalkyl-phosphine oxides and -phosphonates. Michael addition (1,4-addition) of ammonia, aminoesters and aminoalcohols to these azo-alkenes gives functionalized alpha-amino-phosphine oxides and -phosphonates. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.03.192
• 作为产物：
  描述：

  diethyl (propa-1,2-dienyl)phosphonate 在 三乙胺 作用下， 以 二氯甲烷 、 氯仿 为溶剂， 反应 0.75h， 生成 [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-[(E)-1-diethoxyphosphorylprop-1-en-2-yl]iminocarbamate
  参考文献：
  名称：

  Addition of amine derivatives to phosphorylated 1,2-diaza-1,3-butadienes. Synthesis of α-aminophosphonates

  摘要：

  Achiral and chiral 1,2-diaza-1,3-butadienes derived from phosphine oxides and phosphonates are obtained from hydrazonoalkyl-phosphine oxides and -phosphonates. Michael addition (1,4-addition) of ammonia, aminoesters and aminoalcohols to these azo-alkenes gives functionalized alpha-amino-phosphine oxides and -phosphonates. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.03.192

文献信息

• Addition of amine derivatives to phosphorylated 1,2-diaza-1,3-butadienes. Synthesis of α-aminophosphonates
  作者：Francisco Palacios、Domitila Aparicio、Yago López、Jesús M. de los Santos

  DOI：10.1016/j.tetlet.2004.03.192

  日期：2004.5

  Achiral and chiral 1,2-diaza-1,3-butadienes derived from phosphine oxides and phosphonates are obtained from hydrazonoalkyl-phosphine oxides and -phosphonates. Michael addition (1,4-addition) of ammonia, aminoesters and aminoalcohols to these azo-alkenes gives functionalized alpha-amino-phosphine oxides and -phosphonates. (C) 2004 Elsevier Ltd. All rights reserved.