4-fluorophenethyl cyclohexanecarboxylate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-fluorophenethyl cyclohexanecarboxylate
• 英文别名: 2-(4-Fluorophenyl)ethyl cyclohexanecarboxylate；2-(4-fluorophenyl)ethyl cyclohexanecarboxylate
• 化学式: C₁₅H₁₉FO₂
• 分子量: 250.313
• InChiKey: XQIIRPCWDKHLOP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  环己烯 、 对氟苯乙醇 、 sodium formate 在 2-吡啶甲醇 、 十二羰基三钌 作用下， 反应 4.0h， 以77%的产率得到4-fluorophenethyl cyclohexanecarboxylate
  参考文献：
  名称：

  Hydroesterification of Alkenes with Sodium Formate and Alcohols Promoted by Cooperative Catalysis of Ru₃(CO)₁₂ and 2-Pyridinemethanol

  摘要：

  A chelation-assisted hydroesterification reaction of alkenes with sodium formate and alcohols that involves cooperative catalysis by Ru-3(CO)(12) and 2-pyridinemethanol is described. In this three-component coupling reaction, sodium formate serves as the carbon monoxide source.

  DOI：

  10.1021/jo501828j

文献信息

• Hydroesterification of Alkenes with Sodium Formate and Alcohols Promoted by Cooperative Catalysis of Ru₃(CO)₁₂ and 2-Pyridinemethanol
  作者：Dong-Su Kim、Woo-Jin Park、Chang-Hee Lee、Chul-Ho Jun

  DOI：10.1021/jo501828j

  日期：2014.12.19

  A chelation-assisted hydroesterification reaction of alkenes with sodium formate and alcohols that involves cooperative catalysis by Ru-3(CO)(12) and 2-pyridinemethanol is described. In this three-component coupling reaction, sodium formate serves as the carbon monoxide source.