5,11,17-Tris(3,6-ditert-butylcarbazol-9-yl)-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene-8,14,22-trione | 1169703-58-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 5,11,17-Tris(3,6-ditert-butylcarbazol-9-yl)-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene-8,14,22-trione
• 英文别名: 5,11,17-tris(3,6-ditert-butylcarbazol-9-yl)-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene-8,14,22-trione
• CAS: 1169703-58-5
• 化学式: C₈₁H₇₈N₄O₃
• 分子量: 1155.54
• InChiKey: QVMJGWUVEVOFQG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  23
• 重原子数：
  88
• 可旋转键数：
  9
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  69.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2,6,10-triiodobenzo[1,9]chinolizino[3,4,5,6,7-defg]acridin-4,8,12-trione 、 3,6-二叔丁基咔唑 在 2,2'-联吡啶 、 copper(l) iodide 、 potassium carbonate 作用下， 以 邻二氯苯 为溶剂， 反应 24.0h， 以85%的产率得到5,11,17-Tris(3,6-ditert-butylcarbazol-9-yl)-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene-8,14,22-trione
  参考文献：
  名称：

  Synthesis, characterization, and electroluminescent properties of star shaped donor–acceptor dendrimers with carbazole dendrons as peripheral branches and heterotriangulene as central core

  摘要：

  Luminescent and redox-active heterotriangulene-based dendrimers (G1 and G2) of first and second generation have been synthesized, and their photophysical properties, oxidation behaviors, and applications in organic light emitting diodes (OLEDs) have been investigated. The dendrimers show efficient aggregation-induced emissions originated from the carbazole dendrons, heterotriangulene core, intramolecular charge-transfer (ICT), and intermolecular aggregation absorptions. Highest-occupied molecular orbital and lowest-unoccupied molecular orbital (HOMO and LUMO) values were acquired using UV-vis spectroscopy and cyclic voltammetry. The OLEDs fabricated with G1 and G2 as non-doping emitters exhibit exclusive aggregation-induced luminescence peaking at 600 and 630 nm, respectively, and demonstrate a good performance with Maximum luminance of 1586 cd m(-2) at current efficiency of 5.3 cd A(-1) for G1 and 827 cd m(-2) at current efficiency of 6.9 cd A(-1) for G2. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.04.008

文献信息

• Synthesis, characterization, and electroluminescent properties of star shaped donor–acceptor dendrimers with carbazole dendrons as peripheral branches and heterotriangulene as central core
  作者：Huaqiang Zhang、Shimin Wang、Yanqin Li、Bin Zhang、Chenxia Du、Xiangjian Wan、Yongsheng Chen

  DOI：10.1016/j.tet.2009.04.008

  日期：2009.6

  Luminescent and redox-active heterotriangulene-based dendrimers (G1 and G2) of first and second generation have been synthesized, and their photophysical properties, oxidation behaviors, and applications in organic light emitting diodes (OLEDs) have been investigated. The dendrimers show efficient aggregation-induced emissions originated from the carbazole dendrons, heterotriangulene core, intramolecular charge-transfer (ICT), and intermolecular aggregation absorptions. Highest-occupied molecular orbital and lowest-unoccupied molecular orbital (HOMO and LUMO) values were acquired using UV-vis spectroscopy and cyclic voltammetry. The OLEDs fabricated with G1 and G2 as non-doping emitters exhibit exclusive aggregation-induced luminescence peaking at 600 and 630 nm, respectively, and demonstrate a good performance with Maximum luminance of 1586 cd m(-2) at current efficiency of 5.3 cd A(-1) for G1 and 827 cd m(-2) at current efficiency of 6.9 cd A(-1) for G2. (C) 2009 Elsevier Ltd. All rights reserved.