2-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-10-(2-propyl-octyloxy)-decyloxymethyl]-oxirane | 189104-45-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 环氧化物
• 英文名称: 2-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-10-(2-propyl-octyloxy)-decyloxymethyl]-oxirane
• CAS: 189104-45-8
• 化学式: C₂₄H₃₂F₁₆O₃
• 分子量: 672.491
• InChiKey: RKZNJSMCBSCPEL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.89
• 重原子数：
  43.0
• 可旋转键数：
  22.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  30.99
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  2-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-10-(2-propyl-octyloxy)-decyloxymethyl]-oxirane 在 四氯化钛 、 sodium hydride 、 三氟乙酸 作用下， 生成 {2-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-10-(2-propyl-octyloxy)-decyloxy]-1-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-propyl-octyloxy)-decyloxymethyl]-ethoxy}-acetic acid
  参考文献：
  名称：

  Synthesis and preliminary evaluation of a new class of fluorinated amphiphiles designed for in-plane immobilisation of biological macromolecules

  摘要：

  A series of new fluorinated amphiphilic structures has been synthesized. The molecules were designed to prevent the insertion of hydrophobic compounds in between the fatty chains of the amphiphile. Derivatives of vitamin A analogues were prepared in order to perform two-dimensional crystallisation experiments with retinoic acid receptors. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(97)00258-x
• 作为产物：
  描述：

  Trifluoro-methanesulfonic acid 2-propyl-octyl ester 在 sodium hydride 作用下， 生成 2-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-10-(2-propyl-octyloxy)-decyloxymethyl]-oxirane
  参考文献：
  名称：

  Synthesis and preliminary evaluation of a new class of fluorinated amphiphiles designed for in-plane immobilisation of biological macromolecules

  摘要：

  A series of new fluorinated amphiphilic structures has been synthesized. The molecules were designed to prevent the insertion of hydrophobic compounds in between the fatty chains of the amphiphile. Derivatives of vitamin A analogues were prepared in order to perform two-dimensional crystallisation experiments with retinoic acid receptors. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(97)00258-x