2,6-Dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromene | 111730-96-2

• 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: 2,6-Dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromene
• CAS: 111730-96-2
• 化学式: C₂₇H₄₆O
• 分子量: 386.662
• InChiKey: GWMKZFPTBBRKMA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.3
• 重原子数：
  28
• 可旋转键数：
  12
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.78
• 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：

  对甲酚 、 3,7,11,15-四甲基-2-十六碳烯-1-醇 在 邻四氯苯醌 、 三羰基环戊基氯化钼 作用下， 反应 1.0h， 以85%的产率得到2,6-Dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromene
  参考文献：
  名称：

  Synthesis of Chromans via [3 + 3] Cyclocoupling of Phenols with Allylic Alcohols Using a Mo/o-Chloranil Catalyst System

  摘要：

  The combination of a molybdenum complex (CpMoCl(CO)(3) or [CpMo(CO)(3)](2)) and o-chloranil was used as a catalyst in the [3 + 3] cyclocoupling of phenols and allylic alcohols under microwave heating conditions. Substituted chromans were selectively obtained in moderate to good isolated yields.

  DOI：

  10.1021/ol802800s

文献信息

• Synthesis of Chromans via [3 + 3] Cyclocoupling of Phenols with Allylic Alcohols Using a Mo/<i>o</i>-Chloranil Catalyst System
  作者：Yoshihiko Yamamoto、Kouhei Itonaga

  DOI：10.1021/ol802800s

  日期：2009.2.5

  The combination of a molybdenum complex (CpMoCl(CO)(3) or [CpMo(CO)(3)](2)) and o-chloranil was used as a catalyst in the [3 + 3] cyclocoupling of phenols and allylic alcohols under microwave heating conditions. Substituted chromans were selectively obtained in moderate to good isolated yields.