[(2S)-1-hydroxyheptadecan-2-yl] acetate | 930269-30-0

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: [(2S)-1-hydroxyheptadecan-2-yl] acetate
• CAS: 930269-30-0
• 化学式: C₁₉H₃₈O₃
• 分子量: 314.509
• InChiKey: WBAKJHORVDNGKR-IBGZPJMESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  22
• 可旋转键数：
  17
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.95
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  [(2S)-1-hydroxyheptadecan-2-yl] acetate 在 草酰氯 作用下， 以 二氯甲烷 、 二甲基亚砜 为溶剂， 反应 2.0h， 以96%的产率得到[(2S)-1-oxoheptadecan-2-yl] acetate
  参考文献：
  名称：

  Study of the synthesis of poecillanosine

  摘要：

  The synthesis of poecillanosine, a natural N-hydroxy-N-nitroso-alkylamine compound, was studied. Poecillanosine was shown to be unstable under acidic nitrosation conditions. Only degradation compounds of poecillanosine were obtained under such conditions, however, the O-methyl derivative of poecillanosine was synthesised and confirmed. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.12.059
• 作为产物：
  描述：

  [(2S)-1-oxoheptadecan-2-yl] acetate 在 盐酸 、 盐酸羟胺 、 sodium nitrite 作用下， 以 吡啶 为溶剂， 生成 [(2S)-1-hydroxyheptadecan-2-yl] acetate
  参考文献：
  名称：

  Study of the synthesis of poecillanosine

  摘要：

  The synthesis of poecillanosine, a natural N-hydroxy-N-nitroso-alkylamine compound, was studied. Poecillanosine was shown to be unstable under acidic nitrosation conditions. Only degradation compounds of poecillanosine were obtained under such conditions, however, the O-methyl derivative of poecillanosine was synthesised and confirmed. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.12.059