4-[4-(3,15-Diphenyl-10-octacyclo[16.10.1.15,9.02,16.04,14.019,24.025,29.013,30]triaconta-1(28),2(16),3,5,7,9,11,13(30),14,17,19,21,23,25(29),26-pentadecaenyl)-3,5-dimethylphenyl]benzonitrile | 1415105-87-1

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物 - 芳基萘木脂素
• 英文名称: 4-[4-(3,15-Diphenyl-10-octacyclo[16.10.1.15,9.02,16.04,14.019,24.025,29.013,30]triaconta-1(28),2(16),3,5,7,9,11,13(30),14,17,19,21,23,25(29),26-pentadecaenyl)-3,5-dimethylphenyl]benzonitrile
• 英文别名: 4-[4-(3,15-diphenyl-10-octacyclo[16.10.1.15,9.02,16.04,14.019,24.025,29.013,30]triaconta-1(28),2(16),3,5,7,9,11,13(30),14,17,19,21,23,25(29),26-pentadecaenyl)-3,5-dimethylphenyl]benzonitrile
• CAS: 1415105-87-1
• 化学式: C₅₇H₃₅N
• 分子量: 733.912
• InChiKey: OLUZUHXJQBGVDB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  15.3
• 重原子数：
  58
• 可旋转键数：
  4
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  23.8
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  3-Aminofluoranthene-2-carboxylic acid 、 4-(4-Bromo-3,5-dimethylphenyl)benzonitrile 、 3-Brom-8-oxo-7,9-diphenyl-8H-cyclopentacenaphthalin 在 四(三苯基膦)钯 亚硝酸异戊酯 、 potassium acetate 、 联硼酸频那醇酯 、 sodium carbonate 作用下， 以 甲苯 、 二甲基亚砜 、 乙醇 、 水 为溶剂， 反应 6.0h， 生成 4-[4-(3,15-Diphenyl-10-octacyclo[16.10.1.15,9.02,16.04,14.019,24.025,29.013,30]triaconta-1(28),2(16),3,5,7,9,11,13(30),14,17,19,21,23,25(29),26-pentadecaenyl)-3,5-dimethylphenyl]benzonitrile 、 4-[4-(3,15-Diphenyl-8-octacyclo[16.10.1.15,9.02,16.04,14.019,24.025,29.013,30]triaconta-1(28),2(16),3,5(30),6,8,10,12,14,17,19,21,23,25(29),26-pentadecaenyl)-3,5-dimethylphenyl]benzonitrile
  参考文献：
  名称：

  Fused polycyclic compound and organic light-emitting device using the compound

  摘要：

  公开号：

  EP2530071B1

文献信息

• FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE COMPOUND
  申请人：Ohrui Hiroki

  公开号：US20120306727A1

  公开（公告）日：2012-12-06

  Provided are a fused polycyclic compound suitable for use mainly as a component for a blue-light-emitting device, and an organic light-emitting device using the compound. The fused polycyclic compound is represented by the general formulae (1), (2), (8) and (9).

  提供了一种适用于主要用作蓝光发射装置组分的融合多环化合物，以及使用该化合物的有机发光装置。融合多环化合物由一般式（1）、（2）、（8）和（9）表示。
• ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：US20190245152A1

  公开（公告）日：2019-08-08

  An organic electroluminescence device includes an anode, an emitting layer, and a cathode. The emitting layer contains a first compound, a second compound, and a third compound, the first compound being a fluorescent compound, the second compound being a delayed fluorescent compound, the third compound being a compound represented by a formula (3). A singlet energy S 1 (M1) of the first compound, a singlet energy S 1 (M2) of the second compound, and a singlet energy S 1 (M3) of the third compound satisfy a relationship of a Numerical Formula 1. In the formula (3), X 1 to X 14 each independently represent a nitrogen atom or CR 80 . XA is NR 95 , a sulfur atom or an oxygen atom.
• ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPLIANCE
  申请人：IDEMITSU KOSAN CO.,LTD.

  公开号：US20210028365A1

  公开（公告）日：2021-01-28

  An organic electroluminescence device comprising: a cathode; an anode; and an organic layer between the cathode and the anode, wherein the organic layer comprises a compound represented by the following formula (1) and a compound represented by the following formula (11).
• US8952873B2
  申请人：——

  公开号：US8952873B2

  公开（公告）日：2015-02-10
• Fused polycyclic compound and organic light-emitting device using the compound
  申请人：Canon Kabushiki Kaisha

  公开号：EP2530071B1

  公开（公告）日：2013-12-04