6,7-Bis[4-(4-butoxyphenyl)phenyl]-2-(2-decyltetradecyl)-4,9-dithiophen-2-yltriazolo[4,5-g]quinoxaline | 1403388-38-4

• 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: 6,7-Bis[4-(4-butoxyphenyl)phenyl]-2-(2-decyltetradecyl)-4,9-dithiophen-2-yltriazolo[4,5-g]quinoxaline
• 英文别名: 6,7-bis[4-(4-butoxyphenyl)phenyl]-2-(2-decyltetradecyl)-4,9-dithiophen-2-yltriazolo[4,5-g]quinoxaline
• CAS: 1403388-38-4
• 化学式: C₇₂H₈₉N₅O₂S₂
• 分子量: 1120.66
• InChiKey: MZPRXWLYYBTBBH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  24.4
• 重原子数：
  81
• 可旋转键数：
  36
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  131
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  6,7-Bis[4-(4-butoxyphenyl)phenyl]-2-(2-decyltetradecyl)-4,9-dithiophen-2-yltriazolo[4,5-g]quinoxaline 在 N-溴代丁二酰亚胺(NBS) 作用下， 以 氯仿 为溶剂， 以95%的产率得到4,9-Bis(5-bromothiophen-2-yl)-6,7-bis[4-(4-butoxyphenyl)phenyl]-2-(2-decyltetradecyl)triazolo[4,5-g]quinoxaline
  参考文献：
  名称：

  Synthesis and Characterization of a Series of Annelated Benzotriazole Based Polymers with Variable Bandgap

  摘要：

  Here we report the synthesis and characterization of a series of annelated benzotriazole based polymers with variable bandgap. Benzobistriazole monomers reported by us previously were desymmetrized using partial reduction ring opening followed by ring closure to produce a wide range of annelated benzotriazole based monomers. These monomers were co-polymerized with a fluorene moiety to give polymers with bandgaps ranging from 1.16 to 2.41 eV.

  DOI：

  10.1021/jo301281d
• 作为产物：
  描述：

  1,2-bis(4'-butoxybiphenyl-4-yl)ethane-1,2-dione 、 2,6-Bis(2-decyltetradecyl)-4,8-dithiophen-2-yltriazolo[4,5-f]benzotriazol-2-ium-3-ide 在 溶剂黄146 作用下， 反应 24.0h， 以260 mg的产率得到6,7-Bis[4-(4-butoxyphenyl)phenyl]-2-(2-decyltetradecyl)-4,9-dithiophen-2-yltriazolo[4,5-g]quinoxaline
  参考文献：
  名称：

  Synthesis and Characterization of a Series of Annelated Benzotriazole Based Polymers with Variable Bandgap

  摘要：

  Here we report the synthesis and characterization of a series of annelated benzotriazole based polymers with variable bandgap. Benzobistriazole monomers reported by us previously were desymmetrized using partial reduction ring opening followed by ring closure to produce a wide range of annelated benzotriazole based monomers. These monomers were co-polymerized with a fluorene moiety to give polymers with bandgaps ranging from 1.16 to 2.41 eV.

  DOI：

  10.1021/jo301281d

文献信息

• Synthesis and Characterization of a Series of Annelated Benzotriazole Based Polymers with Variable Bandgap
  作者：Teck Lip Dexter Tam、Wanting Ye、Hong Hup Ronnie Tan、Feng Zhou、Haibin Su、Subodh G. Mhaisalkar、Andrew C. Grimsdale

  DOI：10.1021/jo301281d

  日期：2012.11.16

  Here we report the synthesis and characterization of a series of annelated benzotriazole based polymers with variable bandgap. Benzobistriazole monomers reported by us previously were desymmetrized using partial reduction ring opening followed by ring closure to produce a wide range of annelated benzotriazole based monomers. These monomers were co-polymerized with a fluorene moiety to give polymers with bandgaps ranging from 1.16 to 2.41 eV.