N,N'-di(2-octyldodecyl)-[2,3-d:6,7-d']-bi[α,β-dicyanothiophene]naphthalene-1,4,5,8-tetracarboxylic acid diimide | 1257635-68-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: N,N'-di(2-octyldodecyl)-[2,3-d:6,7-d']-bi[α,β-dicyanothiophene]naphthalene-1,4,5,8-tetracarboxylic acid diimide
• 英文别名: 9,19-Bis(2-octyldodecyl)-8,10,18,20-tetraoxo-3,13-dithia-9,19-diazahexacyclo[9.9.2.02,6.07,22.012,16.017,21]docosa-1,4,6,11,14,16,21-heptaene-4,5,14,15-tetracarbonitrile
• CAS: 1257635-68-9
• 化学式: C₆₂H₈₂N₆O₄S₂
• 分子量: 1039.5
• InChiKey: BFVLXARYRKFIFZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  22
• 重原子数：
  74
• 可旋转键数：
  36
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  226
• 氢给体数：
  0
• 氢受体数：
  10

文献信息

• SULFUR CONTAINING HETEROCYCLE-FUSED NAPHTHALENE TETRACARBOXYLIC ACID DIIMIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF
  申请人：Shanghai Institute Of Organic Chemistry, Chinese Academy Of Sciences

  公开号：EP2492271A1

  公开（公告）日：2012-08-29

  Sulfur containing heterocycle- fused naphthalenetetracarboxylic acid diimide derivatives represented by formula (I) are dislcosed, in which, R1 and R2 are C1-C30 and C1-C12 linear alkyl or branched alkyl, respectively; R3 is H or halogen atom. The preparation method of said derivatives and the use thereof in manufacture of organic thin film field effect transistor or organic solar batteries are also disclosed.

  含硫杂环融合萘四甲酸二亚胺衍生物由式（I）代表、 其中，R1 和 R2 分别为 C1-C30 和 C1-C12 直链烷基或支链烷基；R3 为 H 或卤原子。还公开了上述衍生物的制备方法及其在制造有机薄膜场效应晶体管或有机太阳能电池中的用途。
• [EN] SULFUR CONTAINING HETEROCYCLE-FUSED NAPHTHALENE TETRACARBOXYLIC ACID DIIMIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF<br/>[FR] DÉRIVÉS DE DIIMIDE D'ACIDE NAPHTALÈNE-TÉTRACARBOXYLIQUE CONDENSÉ AVEC UN HÉTÉROCYCLE CONTENANT DU SOUFRE, PROCÉDÉ DE PRÉPARATION ET UTILISATION DE CEUX-CI
  申请人：SHANGHAI INST ORGANIC CHEM

  公开号：WO2011047624A1

  公开（公告）日：2011-04-28

  Sulfur containing heterocycle-fused naphthalene tetracarboxylic acid diimide derivatives represented by formula (I) are disclosed, in which R1 and R2 are C1-C30 and C1-C12 linear alkyl or branched alkyl, respectively, and R3 is H or halogen atom. The preparation method of said derivatives and the use thereof in manufacture of organic thin film field effect transistor or organic solar batteries are also disclosed.