4-(4-bromophenylthio)-2-ethylaniline

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 4-(4-bromophenylthio)-2-ethylaniline
• 英文别名: 4-(4-Bromophenyl)sulfanyl-2-ethylaniline；4-(4-bromophenyl)sulfanyl-2-ethylaniline
• 化学式: C₁₄H₁₄BrNS
• 分子量: 308.242
• InChiKey: URUCXKRDIYOVFO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  51.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-乙基苯胺 、 4-溴苯硫酚 在 二叔丁基过氧化物 、 碘 作用下， 反应 24.0h， 以97%的产率得到4-(4-bromophenylthio)-2-ethylaniline
  参考文献：
  名称：

  Metal-Free Iodine-Catalyzed Direct Arylthiation of Substituted Anilines with Thiols

  摘要：

  Iodine-catalyzed direct arylthiation of substituted anilines for the synthesis of various diaryl sulfides has been developed under metal- and solvent-free conditions. The present method uses readily available thiols as the arylthiation reagents, and environmentally friendly and inexpensive I-2 as the catalyst. Importantly, no base or ligand was necessary. Such a simple, efficient, and economical transformation provides an attractive approach to various diaryl sulfides in good to excellent yields.

  DOI：

  10.1021/acs.joc.5b00540

文献信息

• Metal-Free Iodine-Catalyzed Direct Arylthiation of Substituted Anilines with Thiols
  作者：Daoshan Yang、Kelu Yan、Wei Wei、Jing Zhao、Mengqi Zhang、Xuguang Sheng、Guoqing Li、Shenglei Lu、Hua Wang

  DOI：10.1021/acs.joc.5b00540

  日期：2015.6.19

  Iodine-catalyzed direct arylthiation of substituted anilines for the synthesis of various diaryl sulfides has been developed under metal- and solvent-free conditions. The present method uses readily available thiols as the arylthiation reagents, and environmentally friendly and inexpensive I-2 as the catalyst. Importantly, no base or ligand was necessary. Such a simple, efficient, and economical transformation provides an attractive approach to various diaryl sulfides in good to excellent yields.