11,11,28,28-Tetrakis(2-ethylhexyl)-4,7,21,24-tetrathia-16,33-diazadecacyclo[16.16.0.02,16.03,13.05,12.06,10.019,33.020,30.022,29.023,27]tetratriaconta-1,3(13),5(12),6(10),8,14,18,20(30),22(29),23(27),25,31-dodecaene-17,34-dione

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 杂芳族化合物
• 英文名称: 11,11,28,28-Tetrakis(2-ethylhexyl)-4,7,21,24-tetrathia-16,33-diazadecacyclo[16.16.0.02,16.03,13.05,12.06,10.019,33.020,30.022,29.023,27]tetratriaconta-1,3(13),5(12),6(10),8,14,18,20(30),22(29),23(27),25,31-dodecaene-17,34-dione
• 英文别名: 11,11,28,28-tetrakis(2-ethylhexyl)-4,7,21,24-tetrathia-16,33-diazadecacyclo[16.16.0.02,16.03,13.05,12.06,10.019,33.020,30.022,29.023,27]tetratriaconta-1,3(13),5(12),6(10),8,14,18,20(30),22(29),23(27),25,31-dodecaene-17,34-dione
• 化学式: C₆₀H₇₆N₂O₂S₄
• 分子量: 985.5
• InChiKey: BLYTVJNWLKVCIW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  20.4
• 重原子数：
  68
• 可旋转键数：
  24
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  154
• 氢给体数：
  0
• 氢受体数：
  6

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.