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 | 1415105-84-8

• 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-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
• 英文别名: 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
• CAS: 1415105-84-8
• 化学式: C₅₇H₃₅N
• 分子量: 733.912
• InChiKey: YIXGIFDQDYPCAF-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 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT
  申请人：CANON KABUSHIKI KAISHA

  公开号：US20210139417A1

  公开（公告）日：2021-05-13

  An organic compound represented by formula [1]. In the formula rings Q represented by formula [1-1] are each independently present at positions *1 and *2 such that positions * of the rings Q correspond to the positions *1 and *2. The rings Q may be the same or different. R 4 and R 5 represent groups each independently selected from the group consisting of a hydrogen atom and a substituted or unsubstituted aryl group. The rings Q are aromatic hydrocarbons. R 1 to R 3 represent groups each independently selected from the group consisting of a hydrogen atom, a substituted or unsubstituted alkyl group, a substituted or unsubstituted aryl group, and a cyano group. At least one of R 1 to R 3 represents a cyano group.

  一种有机化合物由公式[1]表示。在公式中，由公式[1-1]表示的环Q分别独立地位于*1和*2的位置，使得环Q的*位置对应于*1和*2的位置。环Q可以相同或不同。R4和R5代表各自独立地选择自氢原子和取代或未取代的芳基基团的群组。环Q是芳香族碳氢化合物。R1到R3代表各自独立地选择自氢原子，取代或未取代的烷基基团，取代或未取代的芳基基团和氰基团的群组。至少有一个R1到R3代表氰基团。
• Organic light emitting element, display apparatus, image pickup apparatus, and illumination apparatus
  申请人：CANON KABUSHIKI KAISHA

  公开号：US10840470B2

  公开（公告）日：2020-11-17

  One embodiment of this invention has a first electrode, a first light emitting layer, and a second electrode, in which the first light emitting layer has a first host material and a first dopant material, a lowest triplet excitation energy of the first host material is higher than a lowest triplet excitation energy of the first dopant material, and, when a weight of the first light emitting layer is set to 100 wt %, a concentration of the first dopant material is 0.3 wt % or less.

  本发明的一个实施例具有第一电极、第一发光层和第二电极，其中第一发光层具有第一宿主材料和第一掺杂剂材料，第一宿主材料的最低三重激发能高于第一掺杂剂材料的最低三重激发能，并且当第一发光层的重量设置为 100 wt % 时，第一掺杂剂材料的浓度为 0.3 wt % 或更低。
• 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).