4-(isoquinolin-1-yl)-N,N-di-p-tolylbenzenamine | 940913-48-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 4-(isoquinolin-1-yl)-N,N-di-p-tolylbenzenamine
• 英文别名: N-(4-isoquinolin-1-ylphenyl)-4-methyl-N-(4-methylphenyl)aniline
• CAS: 940913-48-4
• 化学式: C₂₉H₂₄N₂
• 分子量: 400.523
• InChiKey: DTBADAGRFRWXHW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.7
• 重原子数：
  31
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  16.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1-(4-氨基苯基)异喹啉 、 4-碘甲苯 在 bronze powder 、 二苯并-18-冠醚-6 、 potassium carbonate 作用下， 以 邻二氯苯 为溶剂， 反应 24.0h， 以72.3%的产率得到4-(isoquinolin-1-yl)-N,N-di-p-tolylbenzenamine
  参考文献：
  名称：

  Highly-efficiency red-emitting platinum (II) complexes containing 4′-diarylamino-1-phenylisoquinoline ligands in polymer light-emitting diodes: Synthesis, structure, photoelectron and electroluminescence

  摘要：

  Heteroleptic cyclometalated platinum (II) complexes bearing diarylamino-functionalized 1-phenylisoquinoline derivatives as primary ligand and acetyl acetonate as ancillary ligand were prepared and characterized. Single-crystal X-ray diffraction revealed that platinum (II) (4-(isoquinolin-1-yl)-N,N-diphenylbenzenamine-N,C-2') (2,4-pentanedionato-O,O) displayed square planar molecular geometry with Pt center dot center dot center dot Pt separation of 6.328 and 6.275 angstrom. The platinum (II) complexes displayed good thermal and morphological stability, as well as intense ligand-centered fluorescence and pi-pi* phosphorescence at 298 K, as well as strong phosphorescence at 77 K in dichloromethane. The double-layer polymer light-emitting diodes using 6a as emitters and a blend of poly(9,9-dioctylfluorene) and 2-(4-tert-butyl)-phenyl-5-biphenyl-1,3,4-oxadiazole as host matrix exhibit best performance with the maximum external quantum efficiency as high as 8.6% at 0.66 mA cm(-2). (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2009.12.014