3,3,4,4,5,5,6,6,7,7,8-Undecafluoro-1,10-bis-nitrooxy-8-trifluoromethyl-decane | 1026442-13-6

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机含氧阴离子化合物
• 英文名称: 3,3,4,4,5,5,6,6,7,7,8-Undecafluoro-1,10-bis-nitrooxy-8-trifluoromethyl-decane
• 英文别名: [3,3,4,4,5,5,6,6,7,7,8-undecafluoro-10-nitrooxy-8-(trifluoromethyl)decyl] nitrate
• CAS: 1026442-13-6
• 化学式: C₁₁H₈F₁₄N₂O₆
• 分子量: 530.172
• InChiKey: CAUUYGHISIDKRM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.2
• 重原子数：
  33
• 可旋转键数：
  11
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  110
• 氢给体数：
  0
• 氢受体数：
  20

反应信息

• 作为反应物：
  描述：

  3,3,4,4,5,5,6,6,7,7,8-Undecafluoro-1,10-bis-nitrooxy-8-trifluoromethyl-decane 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 硝酸 作用下， 65.0~160.0 ℃ 、2.07 MPa 条件下， 反应 56.0h， 生成 3,3,4,4,5,5,6,6,7,7,8-Undecafluoro-1,10-bis-nitrooxy-8-trifluoromethyl-decane
  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