1,2-bis(5-cyclohexyl-2-methyl-3-thienyl)perfluorocyclopentene | 1170715-82-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 噻吩类
• 英文名称: 1,2-bis(5-cyclohexyl-2-methyl-3-thienyl)perfluorocyclopentene
• 英文别名: 5-Cyclohexyl-3-[2-(5-cyclohexyl-2-methylthiophen-3-yl)-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-methylthiophene；5-cyclohexyl-3-[2-(5-cyclohexyl-2-methylthiophen-3-yl)-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-methylthiophene
• CAS: 1170715-82-8
• 化学式: C₂₇H₃₀F₆S₂
• 分子量: 532.658
• InChiKey: AJHFAGRMODHVNQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.3
• 重原子数：
  35
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  56.5
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  1,2-bis(5-cyclohexyl-2-methyl-3-thienyl)perfluorocyclopentene 以 正己烷 为溶剂， 生成 4,14-Dicyclohexyl-8,8,9,9,10,10-hexafluoro-1,2-dimethyl-3,15-dithiatetracyclo[10.3.0.02,6.07,11]pentadeca-4,6,11,13-tetraene
  参考文献：
  名称：

  Photochromism of diarylethene derivatives having cyclohexyl and cyclohexenyl groups in single-component crystals and a two-component mixed crystal

  摘要：

  Diarylethene derivatives la having two cyclohexyl groups and 2a having a cyclohexyl and a cyclohexenyl group formed a mixed crystal composed of almost equal amounts of the two components, and underwent photochromism in the mixed crystal as well as in the single-component crystals. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.02.139
• 作为产物：
  描述：

  4,14-Dicyclohexyl-8,8,9,9,10,10-hexafluoro-1,2-dimethyl-3,15-dithiatetracyclo[10.3.0.02,6.07,11]pentadeca-4,6,11,13-tetraene 以 正己烷 为溶剂， 生成 1,2-bis(5-cyclohexyl-2-methyl-3-thienyl)perfluorocyclopentene
  参考文献：
  名称：

  Photochromism of diarylethene derivatives having cyclohexyl and cyclohexenyl groups in single-component crystals and a two-component mixed crystal

  摘要：

  Diarylethene derivatives la having two cyclohexyl groups and 2a having a cyclohexyl and a cyclohexenyl group formed a mixed crystal composed of almost equal amounts of the two components, and underwent photochromism in the mixed crystal as well as in the single-component crystals. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.02.139

文献信息

• Photochromism of diarylethene derivatives having cyclohexyl and cyclohexenyl groups in single-component crystals and a two-component mixed crystal
  作者：Masakazu Morimoto、Masahiro Irie

  DOI：10.1016/j.tetlet.2009.02.139

  日期：2009.7

  Diarylethene derivatives la having two cyclohexyl groups and 2a having a cyclohexyl and a cyclohexenyl group formed a mixed crystal composed of almost equal amounts of the two components, and underwent photochromism in the mixed crystal as well as in the single-component crystals. (C) 2009 Elsevier Ltd. All rights reserved.