2-(5-bromothiophen-2-yl)-1-(4-butylphenyl)-1H-phenanthro[9,10-d]imidazole | 1384124-23-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 2-(5-bromothiophen-2-yl)-1-(4-butylphenyl)-1H-phenanthro[9,10-d]imidazole
• CAS: 1384124-23-5
• 化学式: C₂₉H₂₃BrN₂S
• 分子量: 511.485
• InChiKey: JVZZBTRNDJAUFO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.17
• 重原子数：
  33.0
• 可旋转键数：
  5.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  17.82
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  5-溴噻吩-2-甲醛 、 4-正丁基苯胺 、 菲醌 在 ammonium acetate 、 溶剂黄146 作用下， 反应 3.0h， 以43%的产率得到2-(5-bromothiophen-2-yl)-1-(4-butylphenyl)-1H-phenanthro[9,10-d]imidazole
  参考文献：
  名称：

  Functionalized organic dyes containing a phenanthroimidazole donor for dye-sensitized solar cell applications

  摘要：

  Five functionalized organic dyes (H6-10) containing a phenanthroimidazole unit as an electron donor were synthesized and characterized for use in dye-sensitized solar cell (DSSC) applications. Under standard global AM 1.5 solar conditions, the DSSCs based on dye H6 displayed the best performance, with an incident photon-to-current conversion efficiency (IPCE) exceeding 70% at wavelengths of 400-530 nm, a short-circuit photocurrent density of 10.98 mA cm(-2), an open-circuit voltage of 0.68 V. a fill factor of 0.69, and an overall conversion efficiency of 5.12%. This efficiency is similar to 94% of that for JK2 cells (5.46%) and similar to 72% of that for N719 cells (7.07%) under the same conditions. (c) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.04.074