| 1384158-11-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• CAS: 1384158-11-5
• 化学式: C₂₆H₁₉N₃O
• 分子量: 389.456
• InChiKey: UJGDCBKLJHQIKE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.51
• 重原子数：
  30.0
• 可旋转键数：
  5.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  48.99
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  、 氰乙酸 在 哌啶 作用下， 以 乙腈 为溶剂， 反应 5.0h， 以49%的产率得到
  参考文献：
  名称：

  Triphenylamine-based organic dyes containing benzimidazole derivatives for dye-sensitized solar cells

  摘要：

  The synthesis and application to dye-sensitized solar cells of two new triphenylamine-based organic dyes containing benzimidazole derivatives as secondary donors together with a simple triphenylamine derived dye for the purpose of comparison is reported. The photophysical and electrochemical properties of the dyes were investigated by UV-vis spectroscopy and cyclic voltammetry. The introduction of benzimidazole derivatives in the phenyl ring of the triphenylamine core increases the molar extinction coefficients and lambda(max) because of the extension of the pi-conjugation structures of the dyes. Overall conversion efficiencies of similar to 2.5% under full sunlight (AM 1.5G, 100 mW cm(-2)) irradiation were obtained for DSSCs based on these new dyes, under the same conditions, the reference dye and ditetrabutylammonium cis-bis(isothiocyanato) bis(2,2'-bipyridyl-4,4'-dicarboxylato) ruthenium(II) (N719) gave overall conversion efficiencies of 1.23% and 5.61%, respectively. Our findings demonstrate that the introduction of benzimidazole derivatives as secondary donors in triphenylamine-based dye can improve their photovoltaic performance compared to the unsubstituted reference dye in DSSCs. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2012.05.007
• 作为产物：
  描述：

  三苯胺 在 三氯氧磷 作用下， 以 甲醇 、 氯仿 为溶剂， 反应 75.0h， 生成
  参考文献：
  名称：

  Triphenylamine-based organic dyes containing benzimidazole derivatives for dye-sensitized solar cells

  摘要：

  The synthesis and application to dye-sensitized solar cells of two new triphenylamine-based organic dyes containing benzimidazole derivatives as secondary donors together with a simple triphenylamine derived dye for the purpose of comparison is reported. The photophysical and electrochemical properties of the dyes were investigated by UV-vis spectroscopy and cyclic voltammetry. The introduction of benzimidazole derivatives in the phenyl ring of the triphenylamine core increases the molar extinction coefficients and lambda(max) because of the extension of the pi-conjugation structures of the dyes. Overall conversion efficiencies of similar to 2.5% under full sunlight (AM 1.5G, 100 mW cm(-2)) irradiation were obtained for DSSCs based on these new dyes, under the same conditions, the reference dye and ditetrabutylammonium cis-bis(isothiocyanato) bis(2,2'-bipyridyl-4,4'-dicarboxylato) ruthenium(II) (N719) gave overall conversion efficiencies of 1.23% and 5.61%, respectively. Our findings demonstrate that the introduction of benzimidazole derivatives as secondary donors in triphenylamine-based dye can improve their photovoltaic performance compared to the unsubstituted reference dye in DSSCs. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2012.05.007