(5Z,8Z,11Z,14Z)-2,2-Dimethyl-icosa-5,8,11,14-tetraenoyl fluoride | 577973-80-9

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 酰卤
• 英文名称: (5Z,8Z,11Z,14Z)-2,2-Dimethyl-icosa-5,8,11,14-tetraenoyl fluoride
• CAS: 577973-80-9
• 化学式: C₂₂H₃₅FO
• 分子量: 334.518
• InChiKey: JXLWKBYBFJOUOU-GKFVBPDJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.26
• 重原子数：
  24.0
• 可旋转键数：
  14.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  17.07
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  乙二醇 、 (5Z,8Z,11Z,14Z)-2,2-Dimethyl-icosa-5,8,11,14-tetraenoyl fluoride 在 4-二甲氨基吡啶 作用下， 以 乙腈 为溶剂， 反应 18.0h， 生成 α,α-dimethyl arachidonoylethyleneglycol
  参考文献：
  名称：

  Hemisynthesis and preliminary evaluation of novel endocannabinoid analogues

  摘要：

  Three new endocannabinoid analogues in which amide moiety was replaced either by oxomethylene group or ester moiety with simultaneous substitution of both alpha-hydrogens with methyl groups were synthesized and their abilities to interact with CB1-receptor and FAAH were investigated. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00348-2
• 作为产物：
  描述：

  α,α-dimethylarachidonic acid 在 吡啶 、 三聚氟氰 作用下， 以 乙腈 为溶剂， 反应 1.0h， 生成 (5Z,8Z,11Z,14Z)-2,2-Dimethyl-icosa-5,8,11,14-tetraenoyl fluoride
  参考文献：
  名称：

  Hemisynthesis and preliminary evaluation of novel endocannabinoid analogues

  摘要：

  Three new endocannabinoid analogues in which amide moiety was replaced either by oxomethylene group or ester moiety with simultaneous substitution of both alpha-hydrogens with methyl groups were synthesized and their abilities to interact with CB1-receptor and FAAH were investigated. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00348-2