9-苯基-3,6-二[4-(1-苯基-1H-苯并咪唑-2-基)苯基]-9H-咔唑 | 1258780-50-5

• 物质功能分类: 有机原料 - 杂环化合物
• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 中文名称: 9-苯基-3,6-二[4-(1-苯基-1H-苯并咪唑-2-基)苯基]-9H-咔唑
• 英文名称: 9-phenyl-3,6-bis(4-(1-phenyl-1H-benzo[d]imidazol-2-yl)phenyl)-9H-carbazole
• 英文别名: 9-Phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole；9-phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
• CAS: 1258780-50-5
• 化学式: C₅₆H₃₇N₅
• 分子量: 779.943
• InChiKey: CWUOZRFIMAVZLO-UHFFFAOYSA-N

物化性质

• 熔点：
  346-347℃
• 密度：
  1.23±0.1 g/cm3(Predicted)
• 最大波长(λmax)：
  317nm(CH2Cl2)(lit.)

计算性质

• 辛醇/水分配系数(LogP)：
  13.9
• 重原子数：
  61
• 可旋转键数：
  7
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  40.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  咔唑 在 tris-(dibenzylideneacetone)dipalladium(0) 、 N-溴代丁二酰亚胺(NBS) 、 四(三苯基膦)钯 、 三叔丁基膦 、 potassium carbonate 、 sodium t-butanolate 作用下， 以 四氢呋喃 、 二氯甲烷 、 水 、 甲苯 为溶剂， 反应 30.0h， 生成 9-苯基-3,6-二[4-(1-苯基-1H-苯并咪唑-2-基)苯基]-9H-咔唑
  参考文献：
  名称：

  Efficient Phosphorescent Green and Red Organic Light-Emitting Diodes Based on the Novel Carbazole-Type Host Material

  摘要：

  我们开发了一种新型的咔唑类材料，9-苯基-3,6-双(4-(1-苯基-1H-苯并[d]咪唑-2-基)苯基)-9H-咔唑（LPGH 153），并利用LPGH 153作为宿主制造了绿色和红色磷光有机发光二极管（OLED）。红色和绿色设备的最大光效分别为22.2 cd/A和32.2 cd/A。

  DOI：

  10.1166/jnn.2011.3370

文献信息

• A new benzimidazole/carbazole hybrid bipolar material for highly efficient deep-blue electrofluorescence, yellow–green electrophosphorescence, and two-color-based white OLEDs
  作者：Wen-Yi Hung、Liang-Chen Chi、Wei-Jiun Chen、You-Ming Chen、Shu-Hua Chou、Ken-Tsung Wong

  DOI：10.1039/c0jm02143a

  日期：——

  The bipolar molecule CPhBzIm exhibits an excellent solid state photoluminescence quantum yield (ΦPL = 69%), triplet energy (ET = 2.48 eV), and bipolar charge transport ability (μh ≈ μe ≈ 10−6–10−5 cm2 V−1 s−1). We have used it to fabricate a non-doped deep-blue organic light emitting diode (OLED) exhibiting promising performance [ηext = 3%; CIE = (0.16, 0.05)] and to serve as host material for a yellow–green phosphorescent OLED [ηext = 19.2%; CIE = (0.42, 0.56)]. Exploiting these dual roles, we used CPhBzIm in a simple singly doped, two-color-based white OLED (ηext = 7%; CIE = 0.31, 0.33).

  双极分子CPhBzIm表现出优异的固态光致发光量子产率（ΔPL = 69%）、三重态能量（ET = 2.48 eV）和双极电荷传输能力（μh – μe – 10 – 6 – 10） 10-5 cm2 V-1 s-1)。我们用它来制造非掺杂深蓝色有机发光二极管（OLED），表现出良好的性能[Δext = 3%； CIE = (0.16, 0.05)] 并用作黄绿色磷光 OLED 的主体材料 [Δext = 19.2%； CIE = (0.42, 0.56)]。利用这些双重作用，我们在简单的单掺杂、双色白色 OLED 中使用了 CPhBzIm（Δext = 7%；CIE = 0.31, 0.33）。
• ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES
  申请人：CYNORA GMBH

  公开号：US20190177303A1

  公开（公告）日：2019-06-13

  The invention relates to an organic molecule for the use in optoelectronic devices. According to the invention, the organic molecule has a first chemical moiety with a structure of formula I, and two second chemical moieties with a structure of formula II, wherein # represents the binding site of a single bond linking the first chemical moiety to the second chemical moiety; V is selected from the group consisting of CN and CF 3 ; and W is the bond linking the first chemical moiety to one of the two second chemical moieties.

  本发明涉及一种用于光电子器件的有机分子。根据本发明，该有机分子具有一个具有公式I结构的第一化学基团和两个具有公式II结构的第二化学基团，其中#表示将第一化学基团与第二化学基团连接的单键结合位点；V选自CN和CF3组成的群体；W是将第一化学基团与两个第二化学基团之一连接的键。
• RESIN COMPOSITION, LAMINATE, RESIN COMPOSITION LAYER-ATTACHED SEMICONDUCTOR WAFER, SUBSTRATE FOR MOUNTING RESIN COMPOSITION LAYER-ATTACHED SEMICONDUCTOR, AND SEMICONDUCTOR DEVICE
  申请人：MITSUBISHI GAS CHEMICAL COMPANY, INC.

  公开号：EP3786200A1

  公开（公告）日：2021-03-03

  A resin composition that has excellent flux activity, flexibility and storage stability and that is suitable for a pre-applied underfill material is provided. The resin composition of the present invention contains a compound (A) having a phenolic hydroxy group, a metal ion trapping agent (B) and a radical polymerizable compound (C).

  本发明提供了一种树脂组合物，该树脂组合物具有优异的通量活性、柔韧性和贮存稳定性，适用于预涂敷的底部填充材料。本发明的树脂组合物含有一种具有酚羟基的化合物（A）、一种金属离子捕获剂（B）和一种可自由基聚合的化合物（C）。
• RESIN COMPOSITION, LAMINATE, SEMICONDUCTOR WAFER WITH RESIN COMPOSITION LAYER, SUBSTRATE FOR MOUNTING SEMICONDUCTOR WITH RESIN COMPOSITION LAYER AND SEMICONDUCTOR DEVICE
  申请人：MITSUBISHI GAS CHEMICAL COMPANY, INC.

  公开号：US20210277221A1

  公开（公告）日：2021-09-09

  A resin composition that has excellent flux activity, flexibility and storage stability and that is suitable for a pre-applied underfill material is provided. The resin composition contains a compound (A) having a phenolic hydroxy group, a metal ion trapping agent (B) and a radical polymerizable compound (C).
• [EN] BISANTHRACENE DERIVATIVES HAVING SOLUBILIZING SUBSTITUENT, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING SAME<br/>[FR] DÉRIVÉS DE BISANTHRACÈNE AYANT UN SUBSTITUANT SOLUBILISANT, ET DISPOSITIF ÉLECTROLUMINESCENT ORGANIQUE LES UTILISANT<br/>[KO] 가용성 치환기를 갖는 비스안트라센 유도체 및 그들을 이용한 유기 전계 발광 소자
  申请人：LG CHEMICAL LTD

  公开号：WO2021141428A1

  公开（公告）日：2021-07-15

  본 발명은, 유기 EL 디바이스를 위한, 보다 높은 발광 효율을 나타내는 발광 재료, 특히 청색 발광 재료를 제공하는 것을 목적으로 한다. 특히, 소자의 생산성이 뛰어난, 도포법에 의한 유기 EL 디바이스에 적합한 청색 발광 재료를 제공하는 것을 목적으로 한다. 본 발명은, 하기 일반식 (1)의 화합물을, 유기 EL 디바이스의 발광 재료로서 사용하는 것을 특징으로 한다. 일반식 (1) (일반식 (1)에 있어서, X 및 Y는 치환기를 나타내고, X와 Y는 서로 동일하지는 않고, X는 제3급 아민 구조를 포함하는 아릴기이며, Y는 1개의 오르토 위치에 알킬 또는 아릴 치환기를 갖는 페닐기이다. )