6,6,25-tris(2-methoxyethyl)-9-(4-methoxy-N-(4-prop-1-ynoxyphenyl)anilino)-25-(2-prop-1-ynoxyethyl)-28-(4-prop-1-ynoxy-N-(4-prop-1-ynoxyphenyl)anilino)-18,37-diazadecacyclo[18.18.0.02,18.03,15.05,13.07,12.021,37.022,34.024,32.026,31]octatriaconta-1,3,5(13),7(12),8,10,14,16,20,22,24(32),26(31),27,29,33,35-hexadecaene-19,38-dione

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 6,6,25-tris(2-methoxyethyl)-9-(4-methoxy-N-(4-prop-1-ynoxyphenyl)anilino)-25-(2-prop-1-ynoxyethyl)-28-(4-prop-1-ynoxy-N-(4-prop-1-ynoxyphenyl)anilino)-18,37-diazadecacyclo[18.18.0.02,18.03,15.05,13.07,12.021,37.022,34.024,32.026,31]octatriaconta-1,3,5(13),7(12),8,10,14,16,20,22,24(32),26(31),27,29,33,35-hexadecaene-19,38-dione
• 化学式: C₈₄H₇₀N₄O₁₀
• 分子量: 1295.5
• InChiKey: WDOOZMAETXVYKJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16.3
• 重原子数：
  98
• 可旋转键数：
  26
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  121
• 氢给体数：
  0
• 氢受体数：
  12

文献信息

• [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.