1,3,6,8-四(2,3,5,6-四甲基苯基)芘 | 1000391-94-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 中文名称: 1,3,6,8-四(2,3,5,6-四甲基苯基)芘
• 英文名称: 1,3,6,8-tetrakis(2,3,5,6-tetramethylphenyl)pyrene
• 英文别名: 1,3,6,8-Tetrakis(2,3,5,6-tetramethylphenyl)pyrene
• CAS: 1000391-94-5
• 化学式: C₅₆H₅₈
• 分子量: 731.077
• InChiKey: FRMOUBHGIXZYHW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  17.4
• 重原子数：
  56
• 可旋转键数：
  4
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  1,3,6,8-四溴芘 、 2,3,5,6-四甲基苯基硼酸 在 四(三苯基膦)钯 sodium hydroxide 作用下， 以 水 、 甲苯 为溶剂， 以75%的产率得到1,3,6,8-四(2,3,5,6-四甲基苯基)芘
  参考文献：
  名称：

  Steric Inhibition of π-Stacking:  1,3,6,8-Tetraarylpyrenes as Efficient Blue Emitters in Organic Light Emitting Diodes (OLEDs)

  摘要：

  The sterically congested tetraarylpyrenes 1-3, which can be readily accessed by Suzuki coupling, exhibit no-aggregation (pi-stacking) behavior in both solution and solid states. The indisposed tendency of 1-3 toward crystallization and their moderate molecular dimensions permit exploitation as blue light emitting materials in OLEDs with respectable device performances.

  DOI：

  10.1021/ol7023136

文献信息

• Steric Inhibition of π-Stacking:  1,3,6,8-Tetraarylpyrenes as Efficient Blue Emitters in Organic Light Emitting Diodes (OLEDs)
  作者：Jarugu Narasimha Moorthy、Palani Natarajan、Parthasarathy Venkatakrishnan、Duo-Fong Huang、Tahsin J. Chow

  DOI：10.1021/ol7023136

  日期：2007.12.1

  The sterically congested tetraarylpyrenes 1-3, which can be readily accessed by Suzuki coupling, exhibit no-aggregation (pi-stacking) behavior in both solution and solid states. The indisposed tendency of 1-3 toward crystallization and their moderate molecular dimensions permit exploitation as blue light emitting materials in OLEDs with respectable device performances.