4-[(1R)-2-chloro-1-hydroxyethyl]phenol | 871266-52-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 4-[(1R)-2-chloro-1-hydroxyethyl]phenol
• CAS: 871266-52-3
• 化学式: C₈H₉ClO₂
• 分子量: 172.611
• InChiKey: LIRPGLPOHOMCQF-QMMMGPOBSA-N

物化性质

• 沸点：
  327.8±27.0 °C(Predicted)
• 密度：
  1.324±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  仲辛醇 、 2-氯-4'-羟基苯乙酮 在 Tris-HCl buffer 作用下， 反应 24.0h， 生成 (S)-(+)-2-辛醇 、 L-2-辛醇 、 4-[(1R)-2-chloro-1-hydroxyethyl]phenol
  参考文献：
  名称：

  Tandem Concurrent Processes: One-Pot Single-Catalyst Biohydrogen Transfer for the Simultaneous Preparation of Enantiopure Secondary Alcohols

  摘要：

  A novel one-pot tandem biohydrogen transfer process to concurrently obtain two enantiopure sec-alcohols is presented; thus, using a suitable single enzyme and a catalytic amount of cofactor, several interesting building blocks could be easily achieved in an enantiocomplementary fashion, minimizing dramatically the quantity of reagents usually employed in the "coupled-substrate" approach.

  DOI：

  10.1021/jo802350f

文献信息

• Tandem Concurrent Processes: One-Pot Single-Catalyst Biohydrogen Transfer for the Simultaneous Preparation of Enantiopure Secondary Alcohols
  作者：Fabricio R. Bisogno、Iván Lavandera、Wolfgang Kroutil、Vicente Gotor

  DOI：10.1021/jo802350f

  日期：2009.2.20

  A novel one-pot tandem biohydrogen transfer process to concurrently obtain two enantiopure sec-alcohols is presented; thus, using a suitable single enzyme and a catalytic amount of cofactor, several interesting building blocks could be easily achieved in an enantiocomplementary fashion, minimizing dramatically the quantity of reagents usually employed in the "coupled-substrate" approach.