2,4-dioctylthio-benzenamine | 1226710-30-0

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2,4-dioctylthio-benzenamine
• 英文别名: 2,4-Bis(octylsulfanyl)aniline；2,4-bis(octylsulfanyl)aniline
• CAS: 1226710-30-0
• 化学式: C₂₂H₃₉NS₂
• 分子量: 381.69
• InChiKey: TWZODEVLOFCXNP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.1
• 重原子数：
  25
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  76.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2,4-二氯硝基苯 、 1-辛硫醇 在 potassium hydroxide 作用下， 以 poly(ethylene glycol)-600 为溶剂， 反应 2.0h， 以68%的产率得到2,4-dioctylthio-benzenamine
  参考文献：
  名称：

  One-Pot Synthesis of Amine-Substituted Aryl Sulfides and Benzo[b]thiophene Derivatives

  摘要：

  A series of amine-substituted aryl sulfides have been synthesized from nitroaryl halides via a simple one-pot procedure involving metal-free C S cross-coupling and in situ nitro group reduction. Various nitroaryl halides were reacted with thiols in recyclable poly(ethylene glycol) to afford the amine-substituted aryl sulfides in high yield. Additionally, the cross-coupling reactions of nitro- and aldehyde-substituted aryl halides with benzyl thiols under the same reaction conditions were demonstrated to afford benzothiazole and phenylbenzo[b]thiophene derivatives.

  DOI：

  10.1021/ol100816g