2-Acetoxy-1-(dibenzylmethoxy)hexane | 138344-79-3

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: 2-Acetoxy-1-(dibenzylmethoxy)hexane
• 英文别名: 1-(1,3-Diphenylpropan-2-yloxy)hexan-2-yl acetate
• CAS: 138344-79-3
• 化学式: C₂₃H₃₀O₃
• 分子量: 354.489
• InChiKey: QQZAHJGKFRRIDZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  26
• 可旋转键数：
  12
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2,2-Dibenzyl-4-butyl-1,3-dioxalane 、 乙酸酐 生成 2-Acetoxy-1-(dibenzylmethoxy)hexane
  参考文献：
  名称：

  Bartels Birgit, Hunter Roger, J. Org. Chem, 58 (1993) N 24, S 6756-6765

  摘要：

  DOI：

文献信息

• A selectivity study of activated ketal reduction with borane dimethyl sulfide
  作者：Birgit Bartels、Roger Hunter

  DOI：10.1021/jo00076a041

  日期：1993.11

  A chemo- and regioselectivity study of the reagent combination BH3.SMe2/TMSOTf for ketal reduction has been undertaken. It has revealed that simple 1,3-dioxanes reduce cleanly at low temperature in CH2Cl2 while simple 1,3-dioxolanes may give complete ring cleavage and dimerization products. A study of reduction of 4-substituted 1,3-dioxolanes has revealed a solvent-directed regioselectivity which in THF favors the secondary protected derivative. A mechanism is postulated to account for the selectivities based on recent thinking on acetal substitution reactions.
• Hunter, Roger; Bartels, Birgit, Journal of the Chemical Society. Perkin transactions I, 1991, # 11, p. 2887 - 2888
  作者：Hunter, Roger、Bartels, Birgit

  DOI：——

  日期：——
• Bartels Birgit, Hunter Roger, J. Org. Chem, 58 (1993) N 24, S 6756-6765
  作者：Bartels Birgit, Hunter Roger

  DOI：——

  日期：——