Z-3-F-Heptyl 2-propenoic acid | 173441-56-0

• 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: Z-3-F-Heptyl 2-propenoic acid
• 英文别名: (2Z)a4,4,5,5,6,6,7,7,8,8,9,9,10,10,10aPentadecafluorodeca2aenoic acid；(Z)-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluorodec-2-enoic acid
• CAS: 173441-56-0
• 化学式: C₁₀H₃F₁₅O₂
• 分子量: 440.109
• InChiKey: RRROMQAILYJNAL-UPHRSURJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.0
• 重原子数：
  27.0
• 可旋转键数：
  7.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  37.3
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  Z-3-F-Heptyl 2-propenoic acid 在 氯化亚砜 、 sodium hydride 作用下， 以 甲苯 为溶剂， 反应 4.0h， 生成 N-(Z-3-F-Heptyl 2-propenoyl) 10,2-bornane sultam
  参考文献：
  名称：

  Stereoselective synthesis of Z and E 3-F-alkyl 2-propenoates and derivatives

  摘要：

  The stereoselective preparation of 3-F-alkyl 2-propenoates and their derivatives is described. E-isomers are easily obtained by an in situ reduction-olefination from esters of F-acids and phosphonates or by a convenient dehydration of 3-F-alkyl 3-hydroxyesters. Z-isomers an known to be prepared by the hydrogenation of alkynes.

  DOI：

  10.1016/0022-1139(95)03297-q
• 作为产物：
  描述：

  Ethyl 3-F-heptyl propynoate 在 Lindlar's catalyst sodium hydroxide 、 氢气 作用下， 以 乙醇 为溶剂， 反应 24.0h， 生成 Z-3-F-Heptyl 2-propenoic acid
  参考文献：
  名称：

  Stereoselective synthesis of Z and E 3-F-alkyl 2-propenoates and derivatives

  摘要：

  The stereoselective preparation of 3-F-alkyl 2-propenoates and their derivatives is described. E-isomers are easily obtained by an in situ reduction-olefination from esters of F-acids and phosphonates or by a convenient dehydration of 3-F-alkyl 3-hydroxyesters. Z-isomers an known to be prepared by the hydrogenation of alkynes.

  DOI：

  10.1016/0022-1139(95)03297-q

文献信息

• Stereoselective synthesis of Z and E 3-F-alkyl 2-propenoates and derivatives
  作者：Marion Lanier、Raphaël Pastor

  DOI：10.1016/0022-1139(95)03297-q

  日期：1995.11

  The stereoselective preparation of 3-F-alkyl 2-propenoates and their derivatives is described. E-isomers are easily obtained by an in situ reduction-olefination from esters of F-acids and phosphonates or by a convenient dehydration of 3-F-alkyl 3-hydroxyesters. Z-isomers an known to be prepared by the hydrogenation of alkynes.