1,3,5-三[4-(9-咔唑基)苯基]苯 | 160780-82-5

• 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
• 中文名称: 1,3,5-三[4-(9-咔唑基)苯基]苯
• 英文名称: 1,3,5-tris[4-(N-carbazolyl)phenyl]benzene
• 英文别名: 9,9′-(5′-(4-(9H-carbazol-9-yl)phenyl)-[1,1′ :3′,1′’-terphenyl]-4,4′’-diyl)bis(9H-carbazole)；9,9'-[5'-[4-(9H-carbazol-9-yl)phenyl][1,1':3',1"-terphenyl]-4,4"-diyl]bis-9H-carbazole；1,3,5-Tris[4-(9-carbazolyl)phenyl]benzene；9-[4-[3,5-bis(4-carbazol-9-ylphenyl)phenyl]phenyl]carbazole
• CAS: 160780-82-5
• 化学式: C₆₀H₃₉N₃
• 分子量: 801.99
• InChiKey: XCICDYGIJBPNPC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16
• 重原子数：
  63
• 可旋转键数：
  6
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  14.8
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  1,3,5-三[4-(9-咔唑基)苯基]苯 、 a-叠氮基-苯乙酸甲酯 在 silver hexafluoroantimonate 、 氯[三(2,4-二叔丁基苯基)亚磷酸]金 作用下， 以 二氯甲烷 为溶剂， 反应 2.0h， 以63%的产率得到tetramethyl 2,2',2'',2'''-(9,9'-(5'-(4-(3,6-bis(2-methoxy-2-oxo-1-phenylethyl)-9H-carbazol-9-yl)phenyl)-[1,1':3',1''-terphenyl]-4,4''-diyl)bis(9H-carbazole-9,6,3-triyl))tetrakis(2-phenylacetate)
  参考文献：
  名称：

  通过金催化的碳转移反应对咔唑杂环进行多个CH功能化反应

  摘要：

  在本文中，我们描述了咔唑杂环与重氮烷烃的多重CH功能化反应。我们表明，金催化剂在使多个CH功能化反应中能够将多达六个卡宾片段引入到包含多个咔唑单元的分子上或将多个咔唑单元连接成一个分子中发挥着独特的作用。单锅一步式方法可以引入两个不同的卡宾片段，以实现正交脱保护和直接衍生化。

  DOI：

  10.1002/chem.202004724
• 作为产物：
  描述：

  1-(4-咔唑-9-基苯基)乙酮 在 氯化亚砜 作用下， 以 四氢呋喃 、 乙醇 为溶剂， 以38%的产率得到1,3,5-三[4-(9-咔唑基)苯基]苯
  参考文献：
  名称：

  通过咔唑基氧化偶联聚合制得的含氮微孔共轭聚合物：制备，孔隙率和气体吸收

  摘要：

  据报道，通过咔唑基的氧化偶联聚合可轻松制备微孔共轭多咔唑。形成聚合物网络的方法具有经济高效的优势，例如使用廉价的催化剂，温和的反应条件以及需要单一单体。由于偶联聚合不需要其他官能团，例如卤代基团，硼酸和炔烃，因此衍生自单体的特性很可能会完全保留，最终聚合物的结构更易于表征。一系列微孔共轭聚咔唑（CPOP-2-7）具有永久孔隙度，是使用具有非平面刚性构象的通用咔唑基2D和3D共轭核心结构合成的。这些多孔材料的Brunauer-Emmett-Teller比表面积值在510和1430 m 2 g -1之间变化。基于不同结构单元的聚合物的主要孔尺寸位于0.59至0.66nm之间。气体（H 2和CO 2）的吸附等温线表明，在获得的氢中，CPOP-7对氢（1.0 bar和77 K下为1.51 wt％）和二氧化碳（1.0 bar和273 K下为13.2 wt％）表现出最佳的吸收能力。聚合物。此外，其高CH

  DOI：

  10.1002/smll.201301618

文献信息

• ANTHRACENE DERIVATIVE AND LIGHT-EMITTING DEVICES, ELECTRONIC DEVICES, AND LIGHTING DEVICE USING THE ANTHRACENE DERIVATIVE
  申请人：Ogita Kaori

  公开号：US20100099890A1

  公开（公告）日：2010-04-22

  An anthracene derivative is disclosed, and a light-emitting element, a light-emitting device, an electronic device, and a lighting device using the anthracene derivatives are demonstrated. The structure of the anthracene derivative is described in detail in the specification. The use of the anthracene derivative enables the production of a blue emissive light-emitting element having high emission efficiency, excellent purity of emission color, and a long lifetime, which contributes to the production of a high-performance light-emitting device, electronic device, and lighting device.

  揭示了一种蒽衍生物，并展示了使用该蒽衍生物的发光元件、发光装置、电子设备和照明装置。蒽衍生物的结构在说明书中被详细描述。使用蒽衍生物可以生产具有高发射效率、发射颜色纯度优异和长寿命的蓝色发光元件，有助于生产高性能的发光装置、电子设备和照明装置。
• Organic Compound, Light-Emitting Element, Display Module, Lighting Module, Light-Emitting Device, Display Device, Electronic Device, and Lighting Device
  申请人：Semiconductor Energy Laboratory Co., Ltd.

  公开号：US20150243892A1

  公开（公告）日：2015-08-27

  A light-emitting element with high emission efficiency. The light-emitting element includes a pair of electrodes and an EL layer between the pair of electrodes. In the light-emitting element, the EL layer contains at least a light-emitting material, the light-emitting material is a 1,6-bis(diphenylamino)pyrene derivative, and a structural change between an excited state and a ground state in the 1,6-bis(diphenylamino)pyrene derivative is smaller than that in a 1,6-bis(diphenylamino)pyrene derivative in which hydrogen is bonded to ortho positions of two phenyl groups of each of two diphenylamino groups.

  一个发光效率高的发光元件。该发光元件包括一对电极和一对电极之间的EL层。在发光元件中，EL层包含至少一种发光材料，发光材料为1,6-双(二苯基氨基)芘衍生物，且1,6-双(二苯基氨基)芘衍生物在激发态和基态之间的结构变化小于在每个二苯基氨基组的两个苯基的邻位上连接氢的1,6-双(二苯基氨基)芘衍生物。
• Organometallic Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device
  申请人：Inoue Hideko

  公开号：US20110245495A1

  公开（公告）日：2011-10-06

  An object is to provide a novel organometallic complex capable of emitting phosphorescence by using, as a ligand, an organic compound with which a variety of derivatives can be easily synthesized. Another object is to provide an organometallic complex having high heat resistance. Other objects are to provide a light-emitting element having high emission efficiency and to provide a light-emitting device, an electronic device, and a lighting device having reduced power consumption. Provided are an organometallic complex including a structure represented by the following General Formula (G1), and a light-emitting element, a light-emitting device, an electronic device, and a lighting device formed using the organometallic complex including the structure represented by the following General Formula (G1).

  提供一种新型有机金属配合物的目的是利用一种有机化合物作为配体，该有机化合物可以轻松合成各种衍生物，并且能够发射磷光。另一个目的是提供具有高耐热性的有机金属配合物。其他目的包括提供具有高发射效率的发光元件，以及提供具有降低功耗的发光装置、电子装置和照明装置。提供了一种包括以下一般式（G1）所代表的结构的有机金属配合物，以及使用包括以下一般式（G1）所代表的结构的有机金属配合物形成的发光元件、发光装置、电子装置和照明装置。
• ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE
  申请人：OSAKA Harue

  公开号：US20120077987A1

  公开（公告）日：2012-03-29

  A novel substance with which an increase in life and emission efficiency of a light-emitting element can be achieved is provided. A carbazole compound having a structure represented by General Formula (G1) is provided. Note that a substituent which makes the HOMO level and the LUMO level of a compound in which a bond of the substituent is substituted with hydrogen deep and shallow, respectively is used as each of substituents in General Formula (G1) (R 1 , R 2 , Ar 3 , and α 3 ). Further, a substituent which makes the band gap (Bg) and the T1 level of a compound in which a bond of the substituent is substituted with hydrogen wide and high is used as each of the substituents in General Formula (G1) (R 1 , R 2 , Ar 3 , and α 3 ).

  提供一种新型物质，可以实现发光元件寿命和发射效率的提高。提供一种具有通用式（G1）表示的结构的咔唑化合物。请注意，在通用式（G1）中，使取代基的HOMO能级和LUMO能级分别变深和变浅的取代基被用作每个取代基（R1、R2、Ar3和α3）。此外，在通用式（G1)中，使取代基的带隙（Bg）和T1能级分别变宽和变高的取代基被用作每个取代基（R1、R2、Ar3和α3）。
• Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device
  申请人：Semiconductor Energy Laboratory Co., Ltd.

  公开号：US20170117487A1

  公开（公告）日：2017-04-27

  A novel heterocyclic compound is provided. In particular, a novel heterocyclic compound which can improve the element characteristics of a light-emitting element is provided. A novel light-emitting element with high emission efficiency and high heat resistance is provided. A heterocyclic compound represented by General Formula (G1). A represents any of a dibenzothiophenyl group, a dibenzofuranyl group, and a carbazolyl group. DBq represents a dibenzo[f,h]quinoxalinyl group. In addition, n is 0 or 1. Each of Ar1 to Ar4 independently represents a substituted or unsubstituted arylene group having 6 to 10 carbon atoms. In Ar1 to Ar4, the adjacent arylene groups may be bonded to each other to form a ring. When the adjacent arylene groups in Ar1 to Ar4 form a fluorene skeleton, the fluorene skeleton may have a substituent.

  提供了一种新的杂环化合物。具体来说，提供了一种可以改善发光元件特性的新型杂环化合物。提供了一种具有高发射效率和高耐热性的新型发光元件。由通用式（G1）表示的杂环化合物。A代表二苯并噻吩基团、二苯并呋喃基团和咔唑基团中的任意一种。DBq代表二苯并[f,h]喹喔啉基团。此外，n为0或1。Ar1至Ar4中的每一个独立地表示具有6到10个碳原子的取代或未取代芳基基团。在Ar1至Ar4中，相邻的芳基基团可以相互连接形成环。当Ar1至Ar4中的相邻芳基基团形成芴骨架时，芴骨架可以有取代基。

表征谱图