2-[Bromo-(4-chloro-phenyl)-methyl]-4-ethyl-1-methoxy-benzene | 78473-47-9

• 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: 2-[Bromo-(4-chloro-phenyl)-methyl]-4-ethyl-1-methoxy-benzene
• 英文别名: 2-[Bromo-(4-chlorophenyl)methyl]-4-ethyl-1-methoxybenzene
• CAS: 78473-47-9
• 化学式: C₁₆H₁₆BrClO
• 分子量: 339.659
• InChiKey: PMWJITZSNPEMAJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  甲醇 、 2-[Bromo-(4-chloro-phenyl)-methyl]-4-ethyl-1-methoxy-benzene 在 sodium hydroxide 作用下， 反应 1.5h， 生成 (2-methoxy-5-ethylphenyl)(4-chlorophenyl)methyl methyl ether
  参考文献：
  名称：

  Antianaphylactic benzophenones and related compounds

  摘要：

  The synthesis and biological properties of 85 benzophenones and related compounds are described. The majority of the compounds inhibit the release of leukotrienes (LT) C4 and D4 in vitro from sensitized guinea pig chopped lung. In addition, some of the compounds inhibited the release of LTs from passively sensitized human chopped lung and protected guinea pigs from the effects of anaphylaxis in a modified Herxheimer test.

  DOI：

  10.1021/jm00391a010
• 作为产物：
  描述：

  (4-Chloro-phenyl)-(5-ethyl-2-methoxy-phenyl)-methanol 在 氢溴酸 作用下， 反应 0.5h， 以3.63 g的产率得到2-[Bromo-(4-chloro-phenyl)-methyl]-4-ethyl-1-methoxy-benzene
  参考文献：
  名称：

  Antianaphylactic benzophenones and related compounds

  摘要：

  The synthesis and biological properties of 85 benzophenones and related compounds are described. The majority of the compounds inhibit the release of leukotrienes (LT) C4 and D4 in vitro from sensitized guinea pig chopped lung. In addition, some of the compounds inhibited the release of LTs from passively sensitized human chopped lung and protected guinea pigs from the effects of anaphylaxis in a modified Herxheimer test.

  DOI：

  10.1021/jm00391a010