3-(4-methoxyphenyl)-1-methyl-2-(4-nitrophenyl)-4,5-dihydroimidazolium iodide

• 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: 3-(4-methoxyphenyl)-1-methyl-2-(4-nitrophenyl)-4,5-dihydroimidazolium iodide
• 英文别名: 1-(4-Methoxyphenyl)-3-methyl-2-(4-nitrophenyl)-4,5-dihydroimidazol-3-ium;iodide
• 化学式: C₁₇H₁₈N₃O₃*I
• 分子量: 439.253
• InChiKey: AFGUUMWTNBNOIO-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -0.48
• 重原子数：
  24
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  61.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-(4-methoxyphenyl)-1-methyl-2-(4-nitrophenyl)-4,5-dihydroimidazolium iodide 在 C.I.酸性橙108 作用下， 以 乙腈 为溶剂， 反应 12.0h， 以50%的产率得到2-(4-Nitrophenyl)-4,5-dihydrooxazole
  参考文献：
  名称：

  REACTIONS OF 2,3-DIARYL-1-METHYL-4,5-DIHYDROIMIDAZOLIUM IODIDES WITH NUCLEOPHILIC REAGENTS

  摘要：

  2,3-Diaryl imidazolium salts, represented by 1 and 2, reacted with 2-ethanolamine or ethylenediamine to produce 2-aryl oxazolines or imidazolines 5-8 respectively. Their hydrolysis resulted in ring-opened ethylenediamine derivatives 9 and 10. The reduction of 1 and 2 produced partially reduced imidazolidines 11, 12 and 11 reacted further with tryptamine to provide 2,3,4,9-tetrahydro-1-phenyl 1H-pyrido[3,4-b]indole, 13. In all these reactions one-carbon units were successfully transferred to the nucleophilic acceptors, which mimic the one-carbon unit transfer function for tetrahydrofolate coenzymes.

  DOI：

  10.1081/scc-120003644
• 作为产物：
  描述：

  N-(2-氯乙基)-4-硝基-苯甲酰胺 在 五氯化磷 作用下， 以 苯 为溶剂， 反应 0.5h， 生成 3-(4-methoxyphenyl)-1-methyl-2-(4-nitrophenyl)-4,5-dihydroimidazolium iodide
  参考文献：
  名称：

  REACTIONS OF 2,3-DIARYL-1-METHYL-4,5-DIHYDROIMIDAZOLIUM IODIDES WITH NUCLEOPHILIC REAGENTS

  摘要：

  2,3-Diaryl imidazolium salts, represented by 1 and 2, reacted with 2-ethanolamine or ethylenediamine to produce 2-aryl oxazolines or imidazolines 5-8 respectively. Their hydrolysis resulted in ring-opened ethylenediamine derivatives 9 and 10. The reduction of 1 and 2 produced partially reduced imidazolidines 11, 12 and 11 reacted further with tryptamine to provide 2,3,4,9-tetrahydro-1-phenyl 1H-pyrido[3,4-b]indole, 13. In all these reactions one-carbon units were successfully transferred to the nucleophilic acceptors, which mimic the one-carbon unit transfer function for tetrahydrofolate coenzymes.

  DOI：

  10.1081/scc-120003644

文献信息

• REACTIONS OF 2,3-DIARYL-1-METHYL-4,5-DIHYDROIMIDAZOLIUM IODIDES WITH NUCLEOPHILIC REAGENTS
  作者：Chizhong Xia、Junsheng Hao、Yiqing Tang、Yanping Ni、Peiwen Zhou

  DOI：10.1081/scc-120003644

  日期：2002.1

  2,3-Diaryl imidazolium salts, represented by 1 and 2, reacted with 2-ethanolamine or ethylenediamine to produce 2-aryl oxazolines or imidazolines 5-8 respectively. Their hydrolysis resulted in ring-opened ethylenediamine derivatives 9 and 10. The reduction of 1 and 2 produced partially reduced imidazolidines 11, 12 and 11 reacted further with tryptamine to provide 2,3,4,9-tetrahydro-1-phenyl 1H-pyrido[3,4-b]indole, 13. In all these reactions one-carbon units were successfully transferred to the nucleophilic acceptors, which mimic the one-carbon unit transfer function for tetrahydrofolate coenzymes.