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9'-苯基-9H,9H'-3,3'-咔唑 | 1060735-14-9

物质功能分类

医药中间体 - OLED材料中间体

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

9'-苯基-9H,9H'-3,3'-咔唑

中文别名

N-苯基-3,3'-双咔唑；9-苯基-9H,9'H-(3,3')联咔唑

英文名称

9-phenyl-3,3'-bicarbazole

英文别名

9-phenyl-9H,9'H-3,3'-bicarbazole；9-phenyl-9H,9′H-3,3′-bicarbazole；9-phenyl-9H,9’H-3,3’-bicarbazole；N-phenyl-3,3-bicarbazole；9-phenyl-3,3'-bi-9H-carbazole；3-(9-phenyl-9H-carbazol-3-yl)-9H-carbazole；3-(9H-carbazol-3-yl)-9-phenylcarbazole；9-phenyl-3,3′-bis-9H-carbazole；9-phenyl-3,3′-bi-9H-carbazole；9-phenyl-9H,9'H-3,3'-biscarbazole；9’-phenyl-3,3’-bi-9H-carbazole；9-phenyl-9H,9'H-[3,3']bicarbazolyl；9-phenyl-9H,9'H-3,3'-dicarbazole；N-phenyl-3,3'-bi-9H-carbazole

CAS

1060735-14-9

化学式

C₃₀H₂₀N₂

mdl

——

分子量

408.502

InChiKey

GKTLHQFSIDFAJH-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

685.6±37.0 °C(Predicted)
密度：

1.23±0.1 g/cm3(Predicted)

计算性质

辛醇/水分配系数(LogP)：

8.1
重原子数：

32
可旋转键数：

2
环数：

7.0
sp3杂化的碳原子比例：

0.0
拓扑面积：

20.7
氢给体数：

1
氢受体数：

0

安全信息

危险性防范说明：

P273,P305+P351+P338
危险性描述：

H302,H315,H319,H412

SDS

SDS：9b1069c51260f9f87bc81b91f36a9e1b

查看

制备方法与用途

应用

9-苯基-9H,9H'-3,3'-咔唑是一种有机合成中间体，在实验室研发及化工医药合成过程中有着广泛的应用。

上下游信息

上游原料

中文名称	英文名称	CAS号	化学式	分子量
N-苯基咔唑	N-phenylcarbazole	1150-62-5	C₁₈H₁₃N	243.308
3-碘-9苯基咔唑	3-iodo-9-phenyl-9H-carbazole	502161-03-7	C₁₈H₁₂IN	369.204
3-溴-N-苯基咔唑	3-bromo-9-phenyl-9H-carbazole	1153-85-1	C₁₈H₁₂BrN	322.204
N-苯基-3-咔唑硼酸	N-phenyl-9H-carbazol-3-boronic acid	854952-58-2	C₁₈H₁₄BNO₂	287.126
3,3'-联咔唑	9H,9'H-3,3'-bicarbazole	1984-49-2	C₂₄H₁₆N₂	332.404
9-苯基-9H-咔唑-3-硼酸哪醇酯	9-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)-9H-carbazole	1126522-69-7	C₂₄H₂₄BNO₂	369.271

下游产品

中文名称	英文名称	CAS号	化学式	分子量
9,9'-二苯基-9H,9'H-3,3'-联咔唑	9,9'-diphenyl-9H,9'H-3,3'-bicarbazole	57102-62-2	C₃₆H₂₄N₂	484.6
——	3-[9-(4-Carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole	1399855-46-9	C₄₈H₃₁N₃	649.794
——	9-(2-naphthyl)-9'-phenyl-9H,9'H-3,3'-bicarbazole	——	C₄₀H₂₆N₂	534.66
9-苯基-9'-(2-三苯基烯基)-3,3'-双咔唑	9-phenyl-9'-(triphenylen-2-yl)-3,3'-bi-9H-carbazole	1392844-41-5	C₄₈H₃₀N₂	634.78
——	9-(3-bromophenyl)-9’-phenyl-3 ,3’-bis-9H-carbazole	1398394-59-6	C₃₆H₂₃BrN₂	563.496
——	3-(9-Benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole	1392844-40-4	C₄₈H₃₀N₂	634.78
——	B-[4-(9'-phenyl-3,3'-bi-9H-carbazol-9-yl)phenyl]boronic acid	1398394-82-5	C₃₆H₂₅BN₂O₂	528.418
——	3,9-bis(9-phenyl-9H-carbazol-3-yl)-9H-carbazole	1340669-17-1	C₄₈H₃₁N₃	649.794
——	PCCPA	1060735-15-0	C₅₆H₃₆N₂	736.915
——	9-(3-phenylboronic acid)-9'-phenyl-[3,3']bicarbazole	1398394-64-3	C₃₆H₂₅BN₂O₂	528.418
——	9-Phenyl-2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole	——	C₄₈H₃₁N₃	649.794
——	3-[9-(5-Chloropyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole	——	C₃₄H₂₁ClN₄	521.021
——	3-(9-Dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole	1345143-16-9	C₄₂H₂₆N₂O	574.681
——	3-[9-(4-Fluoranthen-3-ylphenyl)carbazol-3-yl]-9-phenylcarbazole	1426401-35-5	C₅₂H₃₂N₂	684.839
——	3-[9-[4-(4-Fluoranthen-3-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole	1426401-43-5	C₅₈H₃₆N₂	760.937
N-苯基咔唑	N-phenylcarbazole	1150-62-5	C₁₈H₁₃N	243.308
——	9-(3-Dibenzofuranyl)-9'-phenyl-3,3'-bi-9H-carbazole	——	C₄₂H₂₆N₂O	574.681
——	9-(dibenzo[b,d]thiophen-2-yl)-9'-phenyl-9H,9'H-3,3'-bicarbazole	1340668-15-6	C₄₂H₂₆N₂S	590.748
——	3-(9-Dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)-6,9-diphenylcarbazole	1340668-20-3	C₅₄H₃₄N₂S	742.943
——	9-(3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl)-9'-phenyl-9H,9'H-3,3'-bicarbazole	1266389-02-9	C₅₁H₃₃N₅	715.857
——	3-(9-Phenylcarbazol-3-yl)-9-[3-(6-phenylpyridin-2-yl)phenyl]carbazole	1383632-60-7	C₄₇H₃₁N₃	637.783
——	9-phenyl-9'-[4-(5-phenyl-1,3,4-oxadiazole-2-yl)phenyl]-3,3'-bi(9H-carbazole)	1245801-46-0	C₄₄H₂₈N₄O	628.733
——	3-(9-Fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole	1392844-39-1	C₄₆H₂₈N₂	608.742
——	3-Bromo-6-(6-bromo-9-dibenzothiophen-2-ylcarbazol-3-yl)-9-phenylcarbazole	1340670-18-9	C₄₂H₂₄Br₂N₂S	748.54
——	3-[9-(4-Dibenzothiophen-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole	1604034-02-7	C₄₈H₃₀N₂S	666.846
——	3-(9-Dibenzofuran-4-ylcarbazol-3-yl)-9-phenylcarbazole	1345143-41-0	C₄₂H₂₆N₂O	574.681
——	9-(dibenzo[b,d]thiophen-4-yl)-9ʹ-phenyl-9H,9'H-3,3ʹ-bicarbazole	1345143-20-5	C₄₂H₂₆N₂S	590.748
——	9-phenyl-9'-[4-(3-phenylqunoxalin-2-yl)phenyl]-3,3'-bi(9H-carbazol)	1245801-43-7	C₅₀H₃₂N₄	688.831
——	3-[9-(3-Dibenzothiophen-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole	1340668-37-2	C₄₈H₃₀N₂S	666.846
9-(4,6-二苯基-1,3,5-三嗪-2-基)-9'-苯基-3,3'-联咔唑	PCCzTzn	1266389-01-8	C₄₅H₂₉N₅	639.759
——	3-[9-(4,6-Diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole	1266389-00-7	C₄₆H₃₀N₄	638.771
——	3-[9-[4-(2-Chloroquinazolin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole	1469860-56-7	C₄₄H₂₇ClN₄	647.178
——	3-(9-Phenylcarbazol-3-yl)-9-[4-[3-(4-phenylphenyl)phenyl]pyrimidin-2-yl]carbazole	1383627-93-7	C₅₂H₃₄N₄	714.869
——	3-[9-(2-Chloroquinazolin-4-yl)carbazol-3-yl]-9-phenylcarbazole	1469860-55-6	C₃₈H₂₃ClN₄	571.08
——	3-(9-Phenylcarbazol-3-yl)-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole	1345338-67-1	C₅₀H₃₂N₄	688.831
——	3-(9-Phenylcarbazol-3-yl)-9-[3-(4-phenylquinazolin-2-yl)phenyl]carbazole	1345338-68-2	C₅₀H₃₂N₄	688.831
——	9-(4-([1,1'-biphenyl]-4-yl)quinazolin-2-yl)-9'-phenyl-9H,9'H-3,3'-bicarbazole	1398393-76-4	C₅₀H₃₂N₄	688.831
——	1-[3-(9-Phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[2,3-c]pyridine	1345970-18-4	C₄₁H₂₅N₃O	575.669
——	1-[3-(9-Phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine	1345143-22-7	C₄₁H₂₅N₃S	591.736
——	3-(9-Phenylcarbazol-3-yl)-9-[2-(4-phenylphenyl)quinazolin-4-yl]carbazole	1469859-99-1	C₅₀H₃₂N₄	688.831

反应信息

作为反应物：

描述：

9'-苯基-9H,9H'-3,3'-咔唑在 potassium phosphate 、 copper(l) iodide 、正丁基锂、乙二胺作用下，以四氢呋喃、正己烷、甲苯为溶剂，反应 27.0h，生成 B-[4-(9'-phenyl-3,3'-bi-9H-carbazol-9-yl)phenyl]boronic acid

参考文献：

名称：

[EN] NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME
[FR] NOUVEAUX COMPOSÉS ÉLECTROLUMINESCENTS ORGANIQUES ET DISPOSITIF ÉLECTROLUMINESCENT ORGANIQUE UTILISANT LESDITS COMPOSÉS

摘要：

本发明涉及一种新型有机电致发光化合物以及使用该化合物的有机电致发光器件。所述有机发光化合物提供了一种具有高发光效率和长寿命操作的有机电致发光器件，需要较低的驱动电压，从而提高功率效率和降低功耗。

公开号：

WO2012121561A1
作为产物：

描述：

3-碘-9苯基咔唑在盐酸、四(三苯基膦)钯、正丁基锂、 sodium carbonate 作用下，以乙醚、正己烷、水、甲苯为溶剂，反应 10.0h，生成 9'-苯基-9H,9H'-3,3'-咔唑

参考文献：

名称：

BIS-CARBAZOLE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME

摘要：

一种由式（1）表示的双咯吡啶衍生物：其中，A1、A2、L1、L2、R1至R4和a至d如规范所定义，可用作形成有机EL器件的材料，包括该衍生物的有机EL器件能够在低电压下驱动，并具有长寿命。

公开号：

EP2690093A1

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文献信息

[EN] MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES<br/>[FR] MATÉRIAUX POUR DISPOSITIFS ÉLECTROLUMINESCENTS ORGANIQUES

申请人：MERCK PATENT GMBH

公开号：WO2018091435A1

公开（公告）日：2018-05-24

The present invention relates to compounds of the formula (1) which are suitable for use in electronic devices, in particular organic electroluminescent devices, and to electronic devices, which comprise these compounds.

本发明涉及适用于电子设备，特别是有机电致发光器件的化合物的公式（1），以及包含这些化合物的电子设备。
Organic electroluminescent element and material for organic electroluminescent elements

申请人：IDEMITSU KOSAN CO., LTD.

公开号：US09711732B2

公开（公告）日：2017-07-18

An organic electroluminescence device includes: a cathode; an anode; and an organic thin-film layer having one or more layers and provided between the anode and the cathode, in which the organic layer includes an emitting layer. The emitting layer includes a first host material, a second host material and a phosphorescent dopant material. The first host material is a compound represented by a formula (1A). The second host material is a compound represented by a formula (2A).

一种有机电致发光器件包括：阴极；阳极；以及具有一个或多个层的有机薄膜层，设置在阳极和阴极之间，其中有机层包括一个发光层。发光层包括第一主体材料、第二主体材料和磷光掺杂材料。第一主体材料是由式（1A）表示的化合物。第二主体材料是由式（2A）表示的化合物。
정공 전달 재료 및 이를 포함하는 유기 전계 발광 소자

申请人：Rohm and Haas Electronic Materials Korea Ltd. 롬엔드하스전자재료코리아유한회사(120080396402) Corp. No ▼ 161514-0000453

公开号：KR20160029399A

公开（公告）日：2016-03-15

본 발명은 정공 전달 재료 및 이를 포함하는 유기 전계 발광 소자에 관한 것이다. 본 발명에 따른 정공 전달 재료를 이용하면, 구동 전압이 낮고 전류 효율 및 전력 효율이 우수하면서도, 구동 수명이 현저히 개선된 유기 전계 발광 소자를 제조할 수 있다.

This is the translation of the text into Chinese: 本发明涉及用于有机电致发光器件的正电荷传输材料及包含其的有机电致发光器件。利用本发明的正电荷传输材料，可以制造出驱动电压低、电流效率和功率效率优越、且驱动寿命显著改善的有机电致发光器件。
[EN] ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME<br/>[FR] COMPOSÉ ORGANIQUE ÉLECTROLUMINESCENT ET DISPOSITIF ORGANIQUE ÉLECTROLUMINESCENT LE COMPRENANT

申请人：ROHM & HAAS ELECT MAT

公开号：WO2015167300A1

公开（公告）日：2015-11-05

The present disclosure relates to an organic electroluminescent compound of Formula 1 (variables R1 -R10 defined herein), and an organic electroluminescent device comprising the same. By using the organic electroluminescent compound according to the present disclosure, it is possible to produce an organic electroluminescent device which can be operated at a lowered driving voltage, shows excellence in luminous efficiency such as current efficiency and power efficiency, and has high color purity and improved lifespan. [Formula should be entered here]

本公开涉及一种具有化学式1（其中定义了变量R1-R10）的有机电致发光化合物，以及包括该化合物的有机电致发光器件。通过使用本公开的有机电致发光化合物，可以制备出可以在较低驱动电压下运行、在发光效率（如电流效率和功率效率）方面表现出色、具有高色纯度和改善寿命的有机电致发光器件。
신규 방향족 복소 고리 유도체, 유기 일렉트로 루미네선스 소자용 재료, 유기 일렉트로 루미네선스 소자용 재료 용액 및 유기 일렉트로 루미네선스 소자

申请人：IDEMITSU KOSAN CO., LTD. 이데미쓰 고산 가부시키가이샤(519980963384)

公开号：KR20150053913A

公开（公告）日：2015-05-19

정공 수송능과 전자 수송능을 분자 내에 겸비하는 특정한 구조를 갖는 신규 방향족 복소 고리 유도체, 그리고 상기 방향족 복소 고리 유도체를 사용한 유기 일렉트로 루미네선스 소자용 재료, 유기 일렉트로 루미네선스 소자용 재료 용액 및 유기 일렉트로 루미네선스 소자를 제공한다.

具有同时具备金属导电性和电子传输性的特定结构的新型芳香族复杂环衍生物，以及用于有机电致发光器件的有机电致发光器件材料，有机电致发光器件材料溶液和有机电致发光器件。