5-[N,N-bis(4-hexyloxyphenylamino)phenyl]-3,3'-diphenylsilylene-2,2'-bithiophene | 1235485-11-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 5-[N,N-bis(4-hexyloxyphenylamino)phenyl]-3,3'-diphenylsilylene-2,2'-bithiophene
• 英文别名: 4-(7,7-diphenyl-3,11-dithia-7-silatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-N,N-bis(4-hexoxyphenyl)aniline
• CAS: 1235485-11-6
• 化学式: C₅₀H₅₁NO₂S₂Si
• 分子量: 790.178
• InChiKey: ZWWIOJZLQLLZRE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.22
• 重原子数：
  56
• 可旋转键数：
  18
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  78.2
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  5-[N,N-bis(4-hexyloxyphenylamino)phenyl]-3,3'-diphenylsilylene-2,2'-bithiophene 、 N,N-二甲基甲酰胺 在 三氯氧磷 作用下， 以78%的产率得到5-[N,N-bis(4-hexyloxyphenylamino)phenyl]-5'-formyl-3,3'-diphenylsilylene-2,2'-bithiophene
  参考文献：
  名称：

  Organic Dyes Containing Coplanar Diphenyl-Substituted Dithienosilole Core for Efficient Dye-Sensitized Solar Cells

  摘要：

  Two new organic dyes adopting coplanar diphenyl-substituted dithienosilole as the central linkage have been synthesized, characterized, and used as the sensitizers for dye-sensitized solar cells (DSSCs). The best DSSC exhibited a high power conversion efficiency up to 7.6% (TP6CADTS) under AM 1.5G irradiation, reaching similar to 96% of the ruthenium dye N719-based reference cell under the same conditions.

  DOI：

  10.1021/jo100762t
• 作为产物：
  描述：

  5-bromo-3,3'-diphenylsilylene-2,2'-bithiophene 、 4-(hexyloxy)-N-(4-(hexyloxy)phenyl)-N-(4-(tributylstannyl)phenyl)aniline 在 四(三苯基膦)钯 作用下， 以 甲苯 为溶剂， 反应 24.0h， 以61%的产率得到5-[N,N-bis(4-hexyloxyphenylamino)phenyl]-3,3'-diphenylsilylene-2,2'-bithiophene
  参考文献：
  名称：

  Organic Dyes Containing Coplanar Diphenyl-Substituted Dithienosilole Core for Efficient Dye-Sensitized Solar Cells

  摘要：

  Two new organic dyes adopting coplanar diphenyl-substituted dithienosilole as the central linkage have been synthesized, characterized, and used as the sensitizers for dye-sensitized solar cells (DSSCs). The best DSSC exhibited a high power conversion efficiency up to 7.6% (TP6CADTS) under AM 1.5G irradiation, reaching similar to 96% of the ruthenium dye N719-based reference cell under the same conditions.

  DOI：

  10.1021/jo100762t

文献信息

• Organic Dyes Containing Coplanar Diphenyl-Substituted Dithienosilole Core for Efficient Dye-Sensitized Solar Cells
  作者：Li-Yen Lin、Chih-Hung Tsai、Ken-Tsung Wong、Tsung-Wei Huang、Lun Hsieh、Su-Hao Liu、Hao-Wu Lin、Chung-Chih Wu、Shu-Hua Chou、Shinn-Horng Chen、An-I Tsai

  DOI：10.1021/jo100762t

  日期：2010.7.16

  Two new organic dyes adopting coplanar diphenyl-substituted dithienosilole as the central linkage have been synthesized, characterized, and used as the sensitizers for dye-sensitized solar cells (DSSCs). The best DSSC exhibited a high power conversion efficiency up to 7.6% (TP6CADTS) under AM 1.5G irradiation, reaching similar to 96% of the ruthenium dye N719-based reference cell under the same conditions.