2,7-bis(4-fluorophenyl)pyrene

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 2,7-bis(4-fluorophenyl)pyrene
• 英文别名: 2,7-Bis(4-fluorophenyl)pyrene
• 化学式: C₂₈H₁₆F₂
• 分子量: 390.432
• InChiKey: AUFGRGIGIADOQI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.5
• 重原子数：
  30
• 可旋转键数：
  2
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  4,5,9,10-四氢芘 在 二硫化碳 、 溴 、 potassium carbonate 、 溶剂黄146 作用下， 以 乙醇 、 水 、 甲苯 为溶剂， 反应 24.75h， 生成 2,7-bis(4-fluorophenyl)pyrene
  参考文献：
  名称：

  Diarylpyrenes vs. diaryltetrahydropyrenes: Crystal structures, fluorescence, and upconversion photochemistry

  摘要：

  The synthesis of two series of substituted 2,7-diaryl-4,5,9,10-tetrahydropyrenes (1a-c) and 2,7-diarylpyrenes (2a-c) is reported; the opposing phenyl tips being terminated with Bu-t (a), OCH3 (b), or F (c) to impart variation in electronic properties. X-ray crystallographic analysis of the six compounds revealed edge-to-face packing predominately due to van der Waals forces in the solid state in all instances. The photophysical properties of these compounds were investigated in solution and in solid state/thin films. Since the 2,7-bis(4-tert-butylphenyl)tetrahydropyrene 1a possesses unity fluorescence quantum efficiency, it was successfully employed as the emitter in a low power upconversion scheme featuring fac-Ir(ppy)(3) [ppy = 2-phenylpyridine] as the photosensitizer. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jphotochem.2013.07.018

文献信息

• Diarylpyrenes vs. diaryltetrahydropyrenes: Crystal structures, fluorescence, and upconversion photochemistry
  作者：Ala’a O. El-Ballouli、Rony S. Khnayzer、Jihane C. Khalife、Alexandr Fonari、Kassem M. Hallal、Tatiana V. Timofeeva、Digambara Patra、Felix N. Castellano、Brigitte Wex、Bilal R. Kaafarani

  DOI：10.1016/j.jphotochem.2013.07.018

  日期：2013.11

  The synthesis of two series of substituted 2,7-diaryl-4,5,9,10-tetrahydropyrenes (1a-c) and 2,7-diarylpyrenes (2a-c) is reported; the opposing phenyl tips being terminated with Bu-t (a), OCH3 (b), or F (c) to impart variation in electronic properties. X-ray crystallographic analysis of the six compounds revealed edge-to-face packing predominately due to van der Waals forces in the solid state in all instances. The photophysical properties of these compounds were investigated in solution and in solid state/thin films. Since the 2,7-bis(4-tert-butylphenyl)tetrahydropyrene 1a possesses unity fluorescence quantum efficiency, it was successfully employed as the emitter in a low power upconversion scheme featuring fac-Ir(ppy)(3) [ppy = 2-phenylpyridine] as the photosensitizer. (C) 2013 Elsevier B.V. All rights reserved.