2-(3-Chlorophenoxy)propan-1-ol | 164200-03-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 2-(3-Chlorophenoxy)propan-1-ol
• CAS: 164200-03-7
• 化学式: C₉H₁₁ClO₂
• 分子量: 186.638
• InChiKey: PPPINLHECKYRRH-UHFFFAOYSA-N

物化性质

• 沸点：
  286.4±15.0 °C(Predicted)
• 密度：
  1.194±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  丁酰氯 、 2-(3-Chlorophenoxy)propan-1-ol 在 吡啶 作用下， 以 二氯甲烷 为溶剂， 生成 Butyric acid 2-(3-chloro-phenoxy)-propyl ester
  参考文献：
  名称：

  Resolution of 2-aryloxy-1-propanols via lipase-catalyzed enantioselective acylation in organic media

  摘要：

  2-Aryloxy-1-propanols, primary alcohols with an oxygyen atom at the stereocenter. were resolved with good to high enantioselectivity by acylation with vinyl butanoate mediated by Pseudomonas sp. lipase in di-iso-propyl ether. Potential factors affecting the enantioselectivity of the enzymatic acylation were examined: solvents. acyl donors mid temperature, Using this enantioselective acylation procedure. enantiomeriocally pure (R)-2-(4-chlorophenoxy)-1-propanol was prepared on a grain scale. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0957-4166(01)00258-0
• 作为产物：
  描述：

  调果酸 在 硼烷 作用下， 以 四氢呋喃 为溶剂， 生成 2-(3-Chlorophenoxy)propan-1-ol
  参考文献：
  名称：

  Resolution of 2-aryloxy-1-propanols via lipase-catalyzed enantioselective acylation in organic media

  摘要：

  2-Aryloxy-1-propanols, primary alcohols with an oxygyen atom at the stereocenter. were resolved with good to high enantioselectivity by acylation with vinyl butanoate mediated by Pseudomonas sp. lipase in di-iso-propyl ether. Potential factors affecting the enantioselectivity of the enzymatic acylation were examined: solvents. acyl donors mid temperature, Using this enantioselective acylation procedure. enantiomeriocally pure (R)-2-(4-chlorophenoxy)-1-propanol was prepared on a grain scale. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0957-4166(01)00258-0

文献信息

• METHODS FOR SCREENING ANTIMICROBIAL AND ANTIVIRAL COMPOUNDS AND USES THEREOF
  申请人：Ausubel Frederick M.

  公开号：US20100216852A1

  公开（公告）日：2010-08-26

  The invention features compounds that have antibacterial activity, their use for the treatment of bacterial infections, screening methods that use whole animals or plant seedlings to identify compounds that inhibit a pathogen in the animal or plant, and screening methods to identify compounds that increase the lifespan of an organism.
• US9301940B2
  申请人：——

  公开号：US9301940B2

  公开（公告）日：2016-04-05
• Resolution of 2-aryloxy-1-propanols via lipase-catalyzed enantioselective acylation in organic media
  作者：Toshifumi Miyazawa、Tomoyuki Yukawa、Takashi Koshiba、Hiroko Sakamoto、Shinichi Ueji、Ryoji Yanagihara、Takashi Yamada

  DOI：10.1016/s0957-4166(01)00258-0

  日期：2001.7

  2-Aryloxy-1-propanols, primary alcohols with an oxygyen atom at the stereocenter. were resolved with good to high enantioselectivity by acylation with vinyl butanoate mediated by Pseudomonas sp. lipase in di-iso-propyl ether. Potential factors affecting the enantioselectivity of the enzymatic acylation were examined: solvents. acyl donors mid temperature, Using this enantioselective acylation procedure. enantiomeriocally pure (R)-2-(4-chlorophenoxy)-1-propanol was prepared on a grain scale. (C) 2001 Elsevier Science Ltd. All rights reserved.