1,4-Bis[4-hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione | 1143584-93-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 双噻吩和低聚噻吩
• 英文名称: 1,4-Bis[4-hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione
• 英文别名: 1,4-bis[4-hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione
• CAS: 1143584-93-3
• 化学式: C₅₄H₆₄N₂O₂S₆
• 分子量: 965.51
• InChiKey: SRKJKJCATTWTID-UHFFFAOYSA-N

物化性质

• 沸点：
  1035.4±65.0 °C(predicted)
• 密度：
  1.26±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  18.6
• 重原子数：
  64
• 可旋转键数：
  26
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  228
• 氢给体数：
  2
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  1,4-Bis[4-hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione 、 1-溴-3-苯基丙烷 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 1,4-Bis[4-hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,5-bis(3-phenylpropyl)pyrrolo[3,4-c]pyrrole-3,6-dione
  参考文献：
  名称：

  [EN] PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE
  [FR] DÉRIVÉS DE PYRROLOPYRROLE, LEUR FABRICATION ET LEUR UTILISATION

  摘要：

  公开号：

  WO2009047104A3
• 作为产物：
  描述：

  di-tert-amyl succinate 、 4-Hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophene-2-carbonitrile 在 iron(III) chloride 、 新戊醇 、 sodium 作用下， 生成 1,4-Bis[4-hexyl-5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione
  参考文献：
  名称：

  [EN] PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE
  [FR] DÉRIVÉS DE PYRROLOPYRROLE, LEUR FABRICATION ET LEUR UTILISATION

  摘要：

  公开号：

  WO2009047104A3

文献信息

• PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE
  申请人：Hao Zhimin

  公开号：US20110004004A1

  公开（公告）日：2011-01-06

  The present invention relates to compounds of the formula (I) wherein the substituents are as defined in claim 1 , and their use as organic semiconductor in organic devices, like diodes, organic field effect transistors and/or a solar cells. The compounds of the formula I have excellent solubility in organic solvents. High efficiency of energy conversion, excellent field-effect mobility, good on/off current ratios and/or excellent stability can be observed, when said compounds are used in semiconductor devices or organic photovoltaic (PV) devices (solar cells).
• Pyrrolopyrrole derivatives, their manufacture and use
  申请人：BASF SE

  公开号：US20130172575A1

  公开（公告）日：2013-07-04

  The present invention relates to compounds of the formula I wherein the substituents are as defined in claim 1, and their use as organic semiconductor in organic devices, like diodes, organic field effect transistors and/or a solar cells. The compounds of the formula I have excellent solubility in organic solvents. High efficiency of energy conversion, excellent field-effect mobility, good on/off current ratios and/or excellent stability can be observed, when said compounds are used in semiconductor devices or organic photovoltaic (PV) devices (solar cells).
• US8404864B2
  申请人：——

  公开号：US8404864B2

  公开（公告）日：2013-03-26
• US9018397B2
  申请人：——

  公开号：US9018397B2

  公开（公告）日：2015-04-28
• [EN] PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE<br/>[FR] DÉRIVÉS DE PYRROLOPYRROLE, LEUR FABRICATION ET LEUR UTILISATION
  申请人：CIBA HOLDING INC

  公开号：WO2009047104A3

  公开（公告）日：2009-06-18