2,2'-(2,5-(1-methylpyrroldiyl))bis(4,5-diphenylimidazole) | 835884-84-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2,2'-(2,5-(1-methylpyrroldiyl))bis(4,5-diphenylimidazole)
• 英文别名: 1H-Imidazole, 2,2'-(1-methyl-1H-pyrrole-2,5-diyl)bis[4,5-diphenyl-；2-[5-(4,5-diphenyl-1H-imidazol-2-yl)-1-methylpyrrol-2-yl]-4,5-diphenyl-1H-imidazole
• CAS: 835884-84-9
• 化学式: C₃₅H₂₇N₅
• 分子量: 517.633
• InChiKey: VWEGZOGZTHXKIU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  40
• 可旋转键数：
  6
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.03
• 拓扑面积：
  62.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2,2'-(2,5-(1-methylpyrroldiyl))bis(4,5-diphenylimidazole) 在 氢氧化钾 、 potassium hexacyanoferrate(III) 作用下， 以 水 、 苯 为溶剂， 反应 0.5h， 以74%的产率得到2-[5-(4,5-Diphenylimidazol-2-ylidene)-1-methylpyrrol-2-ylidene]-4,5-diphenylimidazole
  参考文献：
  名称：

  Preparation, Properties, and Reduction of Heteroaromatic Quinoids with 1,4-Diazacyclopentadien-2-ylidene Terminals

  摘要：

  New n-type heteroaromatic quinoids with 1,4-diazacyclopentadien-2-ylidene terminals were prepared. These quinoids possess strong electron-accepting properties, comparable to dicyanomethylene analogues. Both the radical anions and dianions were generated by metal reduction using 3% Na-Hg in THF and were spectroscopically characterized.

  DOI：

  10.1021/ol0476927
• 作为产物：
  描述：

  1-methyl-1H-pyrrole-2,5-diformaldehyde 、 联苯甲酰 在 乙酸铵 、 溶剂黄146 作用下， 反应 17.0h， 以90%的产率得到2,2'-(2,5-(1-methylpyrroldiyl))bis(4,5-diphenylimidazole)
  参考文献：
  名称：

  Preparation, Properties, and Reduction of Heteroaromatic Quinoids with 1,4-Diazacyclopentadien-2-ylidene Terminals

  摘要：

  New n-type heteroaromatic quinoids with 1,4-diazacyclopentadien-2-ylidene terminals were prepared. These quinoids possess strong electron-accepting properties, comparable to dicyanomethylene analogues. Both the radical anions and dianions were generated by metal reduction using 3% Na-Hg in THF and were spectroscopically characterized.

  DOI：

  10.1021/ol0476927

文献信息

• Preparation, Properties, and Reduction of Heteroaromatic Quinoids with 1,4-Diazacyclopentadien-2-ylidene Terminals
  作者：Masatoshi Kozaki、Asuka Isoyama、Kogen Akita、Keiji Okada

  DOI：10.1021/ol0476927

  日期：2005.1.1

  New n-type heteroaromatic quinoids with 1,4-diazacyclopentadien-2-ylidene terminals were prepared. These quinoids possess strong electron-accepting properties, comparable to dicyanomethylene analogues. Both the radical anions and dianions were generated by metal reduction using 3% Na-Hg in THF and were spectroscopically characterized.