6-benzyloxy-1-phenylcyclohexene | 1269246-95-8

• 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: 6-benzyloxy-1-phenylcyclohexene
• 英文别名: (2-Phenylcyclohex-2-en-1-yl)oxymethylbenzene；(2-phenylcyclohex-2-en-1-yl)oxymethylbenzene
• CAS: 1269246-95-8
• 化学式: C₁₉H₂₀O
• 分子量: 264.367
• InChiKey: IMUPSLVVMIJLBI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  (2-(苄氧基)-2-苯基环己基)(丙基)硫烷 在 indium(III) triflate 、 1-(propylthio)pyrrolidine-2,5-dione 作用下， 以 二氯甲烷 为溶剂， 反应 2.33h， 生成 6-benzyloxy-1-phenylcyclohexene
  参考文献：
  名称：

  An Acid-Catalyzed Formal Allylic C−H Oxidation of Aryl Cycloalkenes with N-Propylthiosuccinimide

  摘要：

  A mild acid-catalyzed formal allylic C-H oxidation of aryl cycloalkenes with N-propylthlosuccinimide in the presence of various nucleophiles to generate allylic ethers, esters, and sulfonamides is described. A possible reaction mechanism has been proposed.

  DOI：

  10.1021/ol200261a

文献信息

• FeCl₃/NaI-Catalyzed Allylic C–H Oxidation of Arylalkenes with a Catalytic Amount of Disulfide under Air
  作者：Deshun Huang、Haining Wang、Fazhen Xue、Yian Shi

  DOI：10.1021/jo201122s

  日期：2011.9.2

  This paper describes a FeCl3/NaI-catalyzed formal allylic C-H oxidation of arylalkenes using a catalytic amount of disulfide with BnOH and 4-nitroaniline as nucleophiles and air as oxidant to form the corresponding allyl ethers and amines. A possible reaction mechanism has been proposed.
• An Acid-Catalyzed Formal Allylic C−H Oxidation of Aryl Cycloalkenes with <i>N</i>-Propylthiosuccinimide
  作者：Deshun Huang、Haining Wang、Huan Guan、Hu Huang、Yian Shi

  DOI：10.1021/ol200261a

  日期：2011.3.18

  A mild acid-catalyzed formal allylic C-H oxidation of aryl cycloalkenes with N-propylthlosuccinimide in the presence of various nucleophiles to generate allylic ethers, esters, and sulfonamides is described. A possible reaction mechanism has been proposed.