1-(4'-chloro-4-methylbiphenyl-2-yl)-N,N-dimethylmethanamine | 1429517-94-1

• 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: 1-(4'-chloro-4-methylbiphenyl-2-yl)-N,N-dimethylmethanamine
• 英文别名: 1-[2-(4-chlorophenyl)-5-methylphenyl]-N,N-dimethylmethanamine
• CAS: 1429517-94-1
• 化学式: C₁₆H₁₈ClN
• 分子量: 259.779
• InChiKey: JPQMEVAWTQFODS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  3-甲基苯甲醛 在 titanium(IV) isopropylate 、 四(三苯基膦)钯 、 silver(I) acetate 、 copper(II) acetate monohydrate 、 溶剂黄146 、 三乙胺 作用下， 以 乙醇 、 2,2,2-三氟乙醇 为溶剂， 反应 84.5h， 生成 1-(4'-chloro-4-methylbiphenyl-2-yl)-N,N-dimethylmethanamine
  参考文献：
  名称：

  Cu(II)-Promoted Palladium-Catalyzed C–H Ortho-Arylation of N,N-Dimethylbenzylamines

  摘要：

  A novel protocol for palladium-catalyzed arylation of the C(sp(2))-H bond directed by a N,N-dimethylaminomethyl group in the presence of AgOAc and Cu(OAc)(2)center dot H2O is described. Various aryl iodides proved to be efficient coupling partners, furnishing the corresponding ortho monoarylated or diarylated arenes in Moderate to good yields. Cu(OAc)(2)center dot H2O is found to be the important additive to improve the yields in this transformation.

  DOI：

  10.1021/jo400186p

文献信息

• Cu(II)-Promoted Palladium-Catalyzed C–H Ortho-Arylation of <i>N</i>,<i>N</i>-Dimethylbenzylamines
  作者：Ruokun Feng、Jinzhong Yao、Zunjun Liang、Zhanxiang Liu、Yuhong Zhang

  DOI：10.1021/jo400186p

  日期：2013.4.19

  A novel protocol for palladium-catalyzed arylation of the C(sp(2))-H bond directed by a N,N-dimethylaminomethyl group in the presence of AgOAc and Cu(OAc)(2)center dot H2O is described. Various aryl iodides proved to be efficient coupling partners, furnishing the corresponding ortho monoarylated or diarylated arenes in Moderate to good yields. Cu(OAc)(2)center dot H2O is found to be the important additive to improve the yields in this transformation.