4-Propan-2-ylidene-1-(2,2,2-trifluoroethyl)cyclohexene | 1415585-65-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 4-Propan-2-ylidene-1-(2,2,2-trifluoroethyl)cyclohexene
• 英文别名: 4-propan-2-ylidene-1-(2,2,2-trifluoroethyl)cyclohexene
• CAS: 1415585-65-7
• 化学式: C₁₁H₁₅F₃
• 分子量: 204.235
• InChiKey: CKVNZVVIDSWVBO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  三氟碘甲烷 、 beta-pinene 在 tris(1,10-phenanthroline)ruthenium(II) dichloride 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 乙腈 为溶剂， 以85%的产率得到4-Propan-2-ylidene-1-(2,2,2-trifluoroethyl)cyclohexene
  参考文献：
  名称：

  Trifluoromethylation of Alkenes by Visible Light Photoredox Catalysis

  摘要：

  A method for trifluoromethylation of alkenes has been developed employing visible light photoredox catalysis with CF3I, Ru(Phen)(3)Cl-2, and DBU. This process works especially well for terminal alkenes to give alkenyl-CF3 products with only E-stereochemistry. The mild reaction conditions enable the trifluoromethylation of a range of alkenes that bear various functional groups.

  DOI：

  10.1021/jo3022346

文献信息

• Trifluoromethylation of Alkenes by Visible Light Photoredox Catalysis
  作者：Naeem Iqbal、Sungkyu Choi、Eunjin Kim、Eun Jin Cho

  DOI：10.1021/jo3022346

  日期：2012.12.21

  A method for trifluoromethylation of alkenes has been developed employing visible light photoredox catalysis with CF3I, Ru(Phen)(3)Cl-2, and DBU. This process works especially well for terminal alkenes to give alkenyl-CF3 products with only E-stereochemistry. The mild reaction conditions enable the trifluoromethylation of a range of alkenes that bear various functional groups.