3,4,5,6-Tetrakis(3,6-dimethylcarbazol-9-yl)benzene-1,2-dicarbonitrile | 1469700-28-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 3,4,5,6-Tetrakis(3,6-dimethylcarbazol-9-yl)benzene-1,2-dicarbonitrile
• CAS: 1469700-28-4
• 化学式: C₆₄H₄₈N₆
• 分子量: 901.125
• InChiKey: ICSJIXCGENKETC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16.29
• 重原子数：
  70.0
• 可旋转键数：
  4.0
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  67.3
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  3,6-二甲基-9H-咔唑 、 3,4,5,6-四氟邻苯二腈 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 、 mineral oil 为溶剂， 反应 10.5h， 以28.6%的产率得到3,4,5,6-Tetrakis(3,6-dimethylcarbazol-9-yl)benzene-1,2-dicarbonitrile
  参考文献：
  名称：

  Organic light-emitting device, and light-emitting material and compound used therefor

  摘要：

  含有以下一般式所代表化合物的发光层的有机发光器件具有高的发光效率。在一般式中，R1至R5中至少有一个代表氰基，至少有一个代表9-咔唑基、1,2,3,4-四氢-9-咔唑基、1-吲哚基或二芳基氨基基团，而R1至R5的余下部分代表氢原子或取代基。

  公开号：

  US09502668B2

文献信息

• ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME
  申请人：LG DISPLAY CO., LTD.

  公开号：US20210119145A1

  公开（公告）日：2021-04-22

  An organic light emitting diode includes a first electrode; a second electrode facing the first electrode; and an emitting material layer including a first compound and a second compound and positioned between the first and second electrodes. An energy level of the first compound and an energy level of the second compound satisfy a pre-determined condition. Further, an organic light emitting device may include the organic light emitting diode.
• LIGHT-EMITTING ELEMENT MATERIAL CONTAINING PYRROMETHENE BORON COMPLEX, LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE
  申请人：Toray Industries, Inc.

  公开号：US20220407007A1

  公开（公告）日：2022-12-22

  The present invention provides a pyrromethene boron complex represented by the general formula (1), a light emitting element material having high luminance efficiency, and a light emitting element: wherein X 1 and X 2 each may be the same or different, and are selected from the group consisting of an alkyl group, a cycloalkyl group, a heterocyclic group, an alkenyl group, a cycloalkenyl group, an alkynyl group, a hydroxyl group, a thiol group, an alkoxy group, a cycloalkoxy group, an alkylthio group, an aryl ether group, an aryl thioether group, an aryl group, a heteroaryl group, halogen and a cyano group. These functional groups may further have a substituent. Ar 1 to Ar 4 each may be the same or different, and are a substituted or unsubstituted aryl group, or a substituted or unsubstituted heteroaryl group. The aryl group and the heteroaryl group may be either a monocyclic ring or a fused ring. However, when one or both of Ar 1 and Ar 2 is/are monocyclic ring(s), the monocyclic ring has one or more secondary alkyl groups, one or more tertiary alkyl groups, one or more aryl groups, or one or more heteroaryl groups as substituents, or has a methyl group and a primary alkyl group as two or more substituents in total. R 1 and R 2 each may be the same or different, and are a substituted or unsubstituted alkyl group, a substituted or unsubstituted aryl group, or a substituted or unsubstituted heteroaryl group. R 3 to R 5 each may be the same or different, and are selected from the group consisting of a hydrogen atom, an alkyl group, a cycloalkyl group, a heterocyclic group, an alkenyl group, a cycloalkenyl group, an alkynyl group, an aryl group, a heteroaryl group, a hydroxyl group, a thiol group, an alkoxy group, an alkylthio group, an aryl ether group, an aryl thioether group, halogen, a cyano group, an aldehyde group, an acyl group, a carboxyl group, an ester group, an amide group, a sulfonyl group, a sulfonic acid ester group, a sulfonamide group, an amino group, a nitro group, a silyl group, and a ring structure with an adjacent group. These functional groups may further have a substituent. R 6 and R 7 each may be the same or different, and are selected from the group consisting of a hydrogen atom, an alkyl group, a cycloalkyl group, a heterocyclic group, an alkenyl group, a cycloalkenyl group, an alkynyl group, an aryl group, a heteroaryl group, a hydroxyl group, a thiol group, an alkoxy group, an alkylthio group, an aryl ether group, an aryl thioether group, halogen, a cyano group, an aldehyde group, an acyl group, a carboxyl group, an ester group, an amide group, a sulfonyl group, a sulfonic acid ester group, a sulfonamide group, an amino group, a nitro group and a silyl group. However, R 6 may be a bridging structure formed by covalent bond via one or two atoms with Ar 4 , and R 7 may be a bridging structure formed by covalent bond via one or two atoms with Ar 3 . These functional groups may further have a substituent.