7-(5-Octylthiophen-2-yl)-4-[3,6,8-tris[7-(5-octylthiophen-2-yl)-2,1,3-benzothiadiazol-4-yl]pyren-1-yl]-2,1,3-benzothiadiazole | 1237525-22-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 7-(5-Octylthiophen-2-yl)-4-[3,6,8-tris[7-(5-octylthiophen-2-yl)-2,1,3-benzothiadiazol-4-yl]pyren-1-yl]-2,1,3-benzothiadiazole
• 英文别名: 7-(5-octylthiophen-2-yl)-4-[3,6,8-tris[7-(5-octylthiophen-2-yl)-2,1,3-benzothiadiazol-4-yl]pyren-1-yl]-2,1,3-benzothiadiazole
• CAS: 1237525-22-2
• 化学式: C₈₈H₉₀N₈S₈
• 分子量: 1516.26
• InChiKey: KYDBEYVCCWXSGH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  32
• 重原子数：
  104
• 可旋转键数：
  36
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  329
• 氢给体数：
  0
• 氢受体数：
  16

反应信息

• 作为产物：
  描述：

  4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7-(5-octylthiophen-2-yl)benzo[c][1,2,5]thiadiazole 、 1,3,6,8-四溴芘 在 四(三苯基膦)钯 、 potassium carbonate 作用下， 以 1,4-二氧六环 为溶剂， 反应 48.0h， 以47%的产率得到7-(5-Octylthiophen-2-yl)-4-[3,6,8-tris[7-(5-octylthiophen-2-yl)-2,1,3-benzothiadiazol-4-yl]pyren-1-yl]-2,1,3-benzothiadiazole
  参考文献：
  名称：

  1,3,6,8-Tetrasubstituted Pyrenes: Solution-Processable Materials for Application in Organic Electronics

  摘要：

  A series of star-shaped organic semiconductors have been synthesized from 1,3,6,8-tetrabromopyrene. The materials are soluble in common organic solvents allowing for solution processing of devices such as light-emitting diodes (OLEDs). One of the materials, 1,3,6,8-tetrakis(4-butoxyphenyl)pyrene, has been used as the active emitting layer In simple solution-processed OLEDs with deep blue emission (CIE = 0.15, 0.18) and maximum efficiencies and brightness levels of 2.56 cd/A and >5000 cd/m(2), respectively.

  DOI：

  10.1021/ol1007179

文献信息

• 1,3,6,8-Tetrasubstituted Pyrenes: Solution-Processable Materials for Application in Organic Electronics
  作者：Prashant Sonar、Mui Siang Soh、Yuen Hsia Cheng、John T. Henssler、Alan Sellinger

  DOI：10.1021/ol1007179

  日期：2010.8.6

  A series of star-shaped organic semiconductors have been synthesized from 1,3,6,8-tetrabromopyrene. The materials are soluble in common organic solvents allowing for solution processing of devices such as light-emitting diodes (OLEDs). One of the materials, 1,3,6,8-tetrakis(4-butoxyphenyl)pyrene, has been used as the active emitting layer In simple solution-processed OLEDs with deep blue emission (CIE = 0.15, 0.18) and maximum efficiencies and brightness levels of 2.56 cd/A and >5000 cd/m(2), respectively.