3,4-dibenzyl-2-chlorophenol

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3,4-dibenzyl-2-chlorophenol
• 化学式: C₂₀H₁₇ClO
• 分子量: 308.807
• InChiKey: ONQSPLZRCOWVSQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  邻氯苯酚 、 溴甲苯 在 zinc(II) chloride 作用下， 反应 2.0h， 以0.6%的产率得到4-苄基-2-氯苯酚
  参考文献：
  名称：

  Identification, library synthesis and anti-vibriosis activity of 2-benzyl-4-chlorophenol from cultures of the marine bacterium Shewanella halifaxensis

  摘要：

  Summer Gut Syndrome (SGS) is caused by various Vibrio bacterial species and can have negative effects on aquaculture farms worldwide. In New Zealand, SGS is caused by Vibrio harveyii infecting King Salmon (Oncorhynchus tshawytscha). To find leads for the prevention of SGS, we screened the inhibitory effects of 16 strains of Shewanella upon V. harveyii growth in competitive solid phase cultures. The detailed investigation of Shewanella halifaxensis IRL548 revealed 2-benzyl-4-chlorophenol (1), a known, commercially available antibacterial agent, as the major bioactive component. Synthesis of a small library of congeners to confirm the natural product identity and to provide a structure-activity relationship for the observed activity was also completed. Compound 1 exhibits moderate activity against two pathogenic microorganisms. (C) 2016 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2016.05.002

文献信息

• US5072017A
  申请人：——

  公开号：US5072017A

  公开（公告）日：1991-12-10
• US5258554A
  申请人：——

  公开号：US5258554A

  公开（公告）日：1993-11-02