2,6-dibenzyl-4-chlorophenol | 40395-08-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: 2,6-dibenzyl-4-chlorophenol
• CAS: 40395-08-2
• 化学式: C₂₀H₁₇ClO
• 分子量: 308.807
• InChiKey: OPLRHCVKTBQKIV-UHFFFAOYSA-N

物化性质

• 沸点：
  444.2±40.0 °C(Predicted)
• 密度：
  1.194±0.06 g/cm3(Predicted)

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：

  苯甲醇 、 对氯苯酚 在 对甲苯磺酸 作用下， 反应 1.5h， 以25%的产率得到2,6-dibenzyl-4-chlorophenol
  参考文献：
  名称：

  2,6-Dibenzyl-4-chlorophenol 화합물을 유효성분으로 하는 암예방 및 치료용 약학적 조성물

  摘要：

  这项发明涉及一种含有2,6-二苄基-4-氯苯酚化合物作为有效成分的癌症预防和治疗组合物，由于2,6-二苄基-4-氯苯酚化合物能够浓度依赖性地抑制A549细胞、DU145细胞、Hela细胞和HepG2细胞中癌细胞的增殖，因此本发明的2,6-二苄基-4-氯苯酚化合物可用作癌症预防和治疗的药学组合物。

  公开号：

  KR101699201B1

文献信息

• Process for preparing benzyl substituted phenols, dibenzylphenolic compounds, and the antioxidant use of such phenols
  申请人：ETHYL CORPORATION

  公开号：EP0186255A2

  公开（公告）日：1986-07-02

  Phenols having an unsubstituted ortho-or para-position may be benzylated by reaction with a benzyl alcohol in contact with an activated alumina catalyst, especially gamma-alumina, at a temperature sufficient to maintain the reactants in the vapor phase. Particularly disclosed are 2, 5-dibenzyl-4-substituted phenols which are optionally substituted in the 3 and 5 positions. The 2, 6-dibenzyl-4- substituted compounds show good antioxidant activity

  具有未取代的正位或对位的苯酚可以通过与活化氧化铝催化剂（尤其是γ-氧化铝）接触的苄醇反应进行苄基化，反应温度足以使反应物保持在气相中。特别公开的是 2，5-二苄基-4-取代苯酚，它们在 3 和 5 位被任选取代。2，6-二苄基-4-取代的化合物显示出良好的抗氧化活性
• Identification, library synthesis and anti-vibriosis activity of 2-benzyl-4-chlorophenol from cultures of the marine bacterium Shewanella halifaxensis
  作者：Sarah L. Moore、Lucile Berthomier、Chriselle D. Braganza、Joanna K. MacKichan、Jason L. Ryan、Gabriel Visnovsky、Robert A. Keyzers

  DOI：10.1016/j.bmcl.2016.05.002

  日期：2016.7

  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.
• BUYSCH, HANS-JOSEF;KLUG, GUNTER;MUES, PETER;PUPPE, LOTHAR
  作者：BUYSCH, HANS-JOSEF、KLUG, GUNTER、MUES, PETER、PUPPE, LOTHAR

  DOI：——

  日期：——
• Verfahren zur Herstellung von p-substituierten o-Benzylphenolen
  申请人：BAYER AG

  公开号：EP0278211B1

  公开（公告）日：1990-08-01
• US5072017A
  申请人：——

  公开号：US5072017A

  公开（公告）日：1991-12-10