2-Heptanol, 1-t-butylthio- | 152398-24-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-Heptanol, 1-t-butylthio-
• 英文别名: 1-tert-butylsulfanylheptan-2-ol
• CAS: 152398-24-8
• 化学式: C₁₁H₂₄OS
• 分子量: 204.377
• InChiKey: UVLYLHHZLVOSHL-UHFFFAOYSA-N

物化性质

• 沸点：
  290.8±13.0 °C(Predicted)
• 密度：
  0.920±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  13
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  45.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-Heptanol, 1-t-butylthio- 在 吡啶 、 4-二甲氨基吡啶 、 sodium hydroxide 、 水 、 trimethoxonium tetrafluoroborate 、 potassium carbonate 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 反应 20.5h， 生成 (2S)-2-戊基环氧乙烷
  参考文献：
  名称：

  Enzyme assisted synthesis of enantiomerically pure δ-lactones

  摘要：

  Both enantiomeric series of a wide variety of optically pure 6-alkylated delta-lactones - saturated as well as unsaturated - were prepared via an enzyme mediated route. The key reaction step is the nucleophilic ring opening of enantiomerically pure alkyl-oxiranes, accessible via the corresponding beta-hydroxythioethers which can be obtained enantiomerically pure via enzyme catalyzed kinetic resolutions.

  DOI：

  10.1016/s0957-4166(00)80146-9
• 作为产物：
  描述：

  1,2-环氧庚烷 、 叔丁基硫醇 在 sodium hydride 作用下， 生成 2-Heptanol, 1-t-butylthio-
  参考文献：
  名称：

  Enzyme assisted synthesis of enantiomerically pure δ-lactones

  摘要：

  Both enantiomeric series of a wide variety of optically pure 6-alkylated delta-lactones - saturated as well as unsaturated - were prepared via an enzyme mediated route. The key reaction step is the nucleophilic ring opening of enantiomerically pure alkyl-oxiranes, accessible via the corresponding beta-hydroxythioethers which can be obtained enantiomerically pure via enzyme catalyzed kinetic resolutions.

  DOI：

  10.1016/s0957-4166(00)80146-9

文献信息

• Enzyme assisted synthesis of enantiomerically pure δ-lactones
  作者：Bernhard Haase、Manfred P. Schneider

  DOI：10.1016/s0957-4166(00)80146-9

  日期：1993.5

  Both enantiomeric series of a wide variety of optically pure 6-alkylated delta-lactones - saturated as well as unsaturated - were prepared via an enzyme mediated route. The key reaction step is the nucleophilic ring opening of enantiomerically pure alkyl-oxiranes, accessible via the corresponding beta-hydroxythioethers which can be obtained enantiomerically pure via enzyme catalyzed kinetic resolutions.