S-propyl 12-hydroxydodecanethioate | 864970-89-8

• 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: S-propyl 12-hydroxydodecanethioate
• CAS: 864970-89-8
• 化学式: C₁₅H₃₀O₂S
• 分子量: 274.468
• InChiKey: DIIRGKSOQSPSLV-UHFFFAOYSA-N

物化性质

• 熔点：
  35 °C
• 沸点：
  378.8±15.0 °C(Predicted)
• 密度：
  0.963±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  18
• 可旋转键数：
  14
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.93
• 拓扑面积：
  62.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  S-propyl 12-hydroxydodecanethioate 在 4-二甲氨基吡啶 、 silver nitrate 、 N,N'-二环己基碳二亚胺 作用下， 以 1,4-二氧六环 、 二氯甲烷 、 氯仿 、 水 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of a photoactivatable phospholipidic probe containing tetrafluorophenylazide

  摘要：

  In order to study lipid-lipid and lipid-protein interactions using a photolabeling approach, we synthesized and characterized a phospholipidic probe in which the photoactivatable tetrafluorophenylazido group is incorporated into the fatty acid chain. This probe is stable in the dark and becomes highly reactive upon being exposed to photoirradiation. It shows fast, clear-cut photochemical reactions and holds promise for further use to study lipid-lipid and protein-lipid interactions. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.06.125
• 作为产物：
  描述：

  12-羟基十二酸 、 丙烷-1-硫醇 在 N,N'-二环己基碳二亚胺 作用下， 以 乙腈 为溶剂， 以80%的产率得到S-propyl 12-hydroxydodecanethioate
  参考文献：
  名称：

  Synthesis of a photoactivatable phospholipidic probe containing tetrafluorophenylazide

  摘要：

  In order to study lipid-lipid and lipid-protein interactions using a photolabeling approach, we synthesized and characterized a phospholipidic probe in which the photoactivatable tetrafluorophenylazido group is incorporated into the fatty acid chain. This probe is stable in the dark and becomes highly reactive upon being exposed to photoirradiation. It shows fast, clear-cut photochemical reactions and holds promise for further use to study lipid-lipid and protein-lipid interactions. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.06.125