1,4-Bis(7,7-didodecyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-2,5-bis(2,2-diethoxyethyl)pyrrolo[3,4-c]pyrrole-3,6-dione

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 噻吩类
• 英文名称: 1,4-Bis(7,7-didodecyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-2,5-bis(2,2-diethoxyethyl)pyrrolo[3,4-c]pyrrole-3,6-dione
• 英文别名: 1,4-bis(7,7-didodecyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-2,5-bis(2,2-diethoxyethyl)pyrrolo[3,4-c]pyrrole-3,6-dione
• 化学式: C₈₄H₁₃₂N₂O₆S₄
• 分子量: 1394.2
• InChiKey: FUMAFYNVNUSCBB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  31.2
• 重原子数：
  96
• 可旋转键数：
  58
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  191
• 氢给体数：
  0
• 氢受体数：
  10

文献信息

• HETEROCYCLIC FLUORESCENT DYES AND METHOD OF PRODUCTION THEREOF
  申请人：BASF SE

  公开号：EP2964704B1

  公开（公告）日：2018-05-16
• NOVEL HETEROCYCLIC FLUORESCENT DYES AND METHOD OF PRODUCTION THEREOF
  申请人：BASF SE

  公开号：US20170133606A1

  公开（公告）日：2017-05-11

  The invention relates to novel compounds of formula (III) that can be used as heterocyclic dyes of unique structure and properties. These compounds can be obtained in a three-step synthesis from simple substrates. The compounds according to the invention have excellent solubility in organic solvents and excellent film-forming properties. In addition, high efficiency of energy conversion, excellent field-effect mobility, good on/off current ratios and/or excellent stability can be observed, when the compounds according to the invention are used in organic field effect transistors, organic photovoltaics (solar cells) and photodiodes.
• US9595680B2
  申请人：——

  公开号：US9595680B2

  公开（公告）日：2017-03-14
• US9893302B2
  申请人：——

  公开号：US9893302B2

  公开（公告）日：2018-02-13
• [EN] NOVEL HETEROCYCLIC FLUORESCENT DYES AND METHOD OF PRODUCTION THEREOF<br/>[FR] NOUVEAUX COLORANTS FLUORESCENTS HÉTÉROCYCLIQUES ET LEUR PROCÉDÉ DE PRÉPARATION
  申请人：BASF SE

  公开号：WO2014135491A1

  公开（公告）日：2014-09-12

  The invention relates to novel compounds of formula (III) that can be used as heterocyclic dyes of unique structure and properties. These compounds can be obtained in a three-step synthesis from simple substrates. The compounds according to the invention have excellent solubility in organic solvents and excellent film-forming properties. In addition, high efficiency of energy conversion, excellent field-effect mobility, good on/off current ratios and/or excellent stability can be observed, when the compounds according to the invention are used in organic field effect transistors, organic photovoltaics (solar cells) and photodiodes.