Acetic acid 10-acetoxy-3,4,4,5,5,6,6,7,7,8,8-undecafluoro-3-trifluoromethyl-decyl ester | 1026565-63-8

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Acetic acid 10-acetoxy-3,4,4,5,5,6,6,7,7,8,8-undecafluoro-3-trifluoromethyl-decyl ester
• 英文别名: [10-acetyloxy-3,4,4,5,5,6,6,7,7,8,8-undecafluoro-3-(trifluoromethyl)decyl] acetate
• CAS: 1026565-63-8
• 化学式: C₁₅H₁₄F₁₄O₄
• 分子量: 524.251
• InChiKey: QXCNZPGOMVYUMW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  33
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  18

反应信息

• 作为反应物：
  描述：

  Acetic acid 10-acetoxy-3,4,4,5,5,6,6,7,7,8,8-undecafluoro-3-trifluoromethyl-decyl ester 在 硫酸 作用下， 以 甲醇 为溶剂， 反应 16.0h， 生成 3-(Trifluoromethyl)-3,4,4,5,5,6,6,7,7,8,8-undecafluorodecane-1,10-diol
  参考文献：
  名称：

  Difunctional Monomers Based on Perfluoropropylene Telomers

  摘要：

  Telomers of perfluoropropylene with alpha,omega-diiodoperfluoroalkanes were converted to branched-chain difunctional condensation monomers. The reaction of ethylene with the telomers gave alpha,omega-bis(iodoethyl)perfluoroalkanes, which were converted to the corresponding diols by reaction with fuming sulfuric acid. The reaction of the branched-chain alpha,omega-bis(iodoethyl)perfluoroalkane a with sodium azide gave the corresponding alpha,omega-bis(azidoethyl)perfluoroalkanes. Hydrogenation of the alpha,omega-bis(azidoethyl)perfluoroalkanes gave diamines. Phosgenation of the amino groups gave diisocyanates.

  DOI：

  10.1021/jo00101a048
• 作为产物：
  描述：

  1,6-Diiodoperfluoroheptane 在 硫酸 、 硝酸 作用下， 65.0~160.0 ℃ 、2.07 MPa 条件下， 反应 56.0h， 生成 Acetic acid 10-acetoxy-3,4,4,5,5,6,6,7,7,8,8-undecafluoro-3-trifluoromethyl-decyl ester
  参考文献：
  名称：

  Difunctional Monomers Based on Perfluoropropylene Telomers

  摘要：

  Telomers of perfluoropropylene with alpha,omega-diiodoperfluoroalkanes were converted to branched-chain difunctional condensation monomers. The reaction of ethylene with the telomers gave alpha,omega-bis(iodoethyl)perfluoroalkanes, which were converted to the corresponding diols by reaction with fuming sulfuric acid. The reaction of the branched-chain alpha,omega-bis(iodoethyl)perfluoroalkane a with sodium azide gave the corresponding alpha,omega-bis(azidoethyl)perfluoroalkanes. Hydrogenation of the alpha,omega-bis(azidoethyl)perfluoroalkanes gave diamines. Phosgenation of the amino groups gave diisocyanates.

  DOI：

  10.1021/jo00101a048