N-((1,4-dioxan-2-yl)(4-methoxyphenyl)methyl)-3-bromoaniline

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: N-((1,4-dioxan-2-yl)(4-methoxyphenyl)methyl)-3-bromoaniline
• 英文别名: 3-bromo-N-[1,4-dioxan-2-yl-(4-methoxyphenyl)methyl]aniline
• 化学式: C₁₈H₂₀BrNO₃
• 分子量: 378.266
• InChiKey: OQSNDENMVMLPSZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  39.7
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1,4-二氧六环 、 4-甲氧基苯甲醛 、 间溴苯胺 在 ammonium persulfate 、 dioxide titanium 作用下， 以 水 为溶剂， 反应 20.0h， 以83%的产率得到N-((1,4-dioxan-2-yl)(4-methoxyphenyl)methyl)-3-bromoaniline
  参考文献：
  名称：

  Light promoted aqueous phase amine synthesis via three-component coupling reactions

  摘要：

  By applying a simple TiO2-(NH4)(2)S2O8 system and promoted by UV light, the three-component reactions of cyclic ether, aniline and aldehyde can be progressed efficiently. 29 substituted amines with different structures were synthesized with up to 97% isolated yields. Isotope effect study revealed that the rate-determining step might be the nucleophilic addition step but not radical generation. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.07.060

文献信息

• Light promoted aqueous phase amine synthesis via three-component coupling reactions
  作者：Lina Zhang、Youquan Deng、Feng Shi

  DOI：10.1016/j.tetlet.2013.07.060

  日期：2013.9

  By applying a simple TiO2-(NH4)(2)S2O8 system and promoted by UV light, the three-component reactions of cyclic ether, aniline and aldehyde can be progressed efficiently. 29 substituted amines with different structures were synthesized with up to 97% isolated yields. Isotope effect study revealed that the rate-determining step might be the nucleophilic addition step but not radical generation. (C) 2013 Elsevier Ltd. All rights reserved.