N,N'-Bis[4-(diphenylamino)phenyl]-N,N'-diphenyl-1,3-diaminobenzene di(cation radical) | 176243-72-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N,N'-Bis[4-(diphenylamino)phenyl]-N,N'-diphenyl-1,3-diaminobenzene di(cation radical)
• 英文别名: N~1~,N~3~-Bis[4-(diphenylamino)phenyl]-N~1~,N~3~-diphenylbenzene-1,3-diamine；1-N,3-N-diphenyl-1-N,3-N-bis[4-(N-phenylanilino)phenyl]benzene-1,3-diamine
• CAS: 176243-72-4
• 化学式: C₅₄H₄₂N₄
• 分子量: 746.954
• InChiKey: PQKHQIGNWMQMIQ-UHFFFAOYSA-N

物化性质

• 密度：
  1.216±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  14.9
• 重原子数：
  58
• 可旋转键数：
  12
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  13
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N,N'-二苯基间苯二胺 在 copper(l) iodide 、 正丁基锂 、 thianthrenium perchlorate 、 thiantrhenium perchlorate 、 三氟乙酸 作用下， 以 二苯醚 、 二氯甲烷 为溶剂， 生成 N,N'-Bis[4-(diphenylamino)phenyl]-N,N'-diphenyl-1,3-diaminobenzene di(cation radical)
  参考文献：
  名称：

  Stable triplet-state di(cation radical)s of a N-phenylaniline oligomer

  摘要：

  N,N'-双[4-(二苯基氨基)-苯基]-N,N'-二苯基-1,3-二氨基苯的双电子氧化产生具有三线态基态的室温稳定的二(阳离子自由基)来自 EPR 光谱。

  DOI：

  10.1039/cc9960000267

文献信息

• Functional thin film
  申请人：Takahashi Tamotsu

  公开号：US20050240061A1

  公开（公告）日：2005-10-27

  The present invention provides organic electroluminescent elements selected from polyacene derivatives represented by general formula (I) below: [wherein, R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 , R 8 , R 9 , R 10 , A 1 and A 2 , which are the same or different, each represents hydrogen atom, a hydrocarbon group, etc., and n denotes an integer of not less than 1]. The organic electroluminescent elements of the present invention can provide materials for organic electroluminescent elements and organic electroluminescent elements, which are excellent in stability, durability, luminance and luminance efficiency.

  本发明提供了选择自下述一般式（I）所代表的聚芳烃衍生物的有机电致发光元件：[其中，R1、R2、R3、R4、R5、R6、R7、R8、R9、R10、A1和A2，它们相同或不同，分别代表氢原子、烃基等，n表示不小于1的整数]。本发明的有机电致发光元件可以提供用于有机电致发光元件和有机电致发光元件的材料，这些元件在稳定性、耐久性、亮度和发光效率方面都表现出优异的特性。
• High-Spin Cation Radicals of <i>Meta</i>−<i>Para</i> Aniline Oligomers
  作者：M. M. Wienk、R. A. J. Janssen

  DOI：10.1021/ja963772x

  日期：1997.5.1

  A series of linear and branched high-spin di- and tri(cation radical)s (12•2+, 72•2+, 33•3+, 43•3+, and 93•3+) has been prepared by oxidation of the corresponding meta−para aniline oligomers. The oligo(cation radical)s are stable under ambient conditions. The formation and properties of the cation radicals has been studied in detail by cyclic voltammetry and UV−vis−near IR spectroscopy. ESR spectroscopy

  通过氧化制备了一系列线性和支化的高自旋双和三阳离子自由基（12•2+、72•2+、33•3+、43•3+和93•3+）相应的间对苯胺低聚物。低聚（阳离子自由基）在环境条件下是稳定的。已经通过循环伏安法和紫外-可见-近红外光谱详细研究了阳离子自由基的形成和性质。ESR 光谱提供了零场分裂，这与分子的拓扑结构和未配对电子的定位一致。变温 ESR 测量表明信号强度遵循居里定律，与低能量高自旋状态一致。
• HYDROCARBON COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT
  申请人：Mitsui Chemicals, Inc.

  公开号：EP1221434A1

  公开（公告）日：2002-07-10

  An electroluminescent element in which at least one layer containing at least one of novel hydrocarbon compounds with an anthracene ring and a fluorene ring directly bound is held between a pair of electrodes. The compounds can advantageously be used in a luminescent element and provide an organic electroluminescent element having an excellent luminescent efficiency and a long luminescent life.

  一种电致发光元件，其中至少有一层含有直接结合了蒽环和芴环的新型碳氢化合物。这些化合物可以很好地应用于发光元件中，并提供一种发光效率高、发光寿命长的有机电致发光元件。
• FUNCTIONAL THIN FILM
  申请人：Japan Science and Technology Agency

  公开号：EP1493796A1

  公开（公告）日：2005-01-05

  The present invention provides organic electroluminescent elements selected from polyacene derivatives represented by general formula (I) below: [wherein, R1, R2, R3, R4, R5, R6, R7, R8, R9, R10, A1 and A2, which are the same or different, each represents hydrogen atom, a hydrocarbon group, etc., and n denotes an integer of not less than 1]. The organic electroluminescent elements of the present invention can provide materials for organic electroluminescent elements and organic electroluminescent elements, which are excellent in stability, durability, luminance and luminance efficiency.

  本发明提供的有机电致发光元件选自以下通式 (I) 所代表的聚乙炔衍生物： [其中，R1、R2、R3、R4、R5、R6、R7、R8、R9、R10、A1和A2相同或不同，各自代表氢原子、烃基等，n表示不小于1的整数]。本发明的有机电致发光元件可以提供稳定性、耐久性、亮度和发光效率都非常优异的有机电致发光元件材料和有机电致发光元件。
• POLYMER CONTAINING SULFO GROUP AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE POLYMER
  申请人：Mitsui Chemicals, Inc.

  公开号：EP1935919A1

  公开（公告）日：2008-06-25

  A polymer compound suitable for use in organic electroluminescent elements; a process for producing the compound; and an organic electroluminescent element employing the compound. The polymer is a sulfo-containing polymer characterized by having a structure formed by introducing sulfo groups into a polymer comprising repeating units represented by the general formula (1): wherein, in the formula, Ar1 and Ar2 each represents a monovalent aromatic group; Y represents a divalent group comprising an aromatic group; and W represents a divalent aromatic group having 4 to 30 carbon atoms.

  一种适用于有机电致发光元件的聚合物化合物；一种生产该化合物的工艺；以及一种采用该化合物的有机电致发光元件。该聚合物是一种含磺基聚合物，其特征是具有一种通过在包含通式（1）所代表的重复单元的聚合物中引入磺基而形成的结构： 式中，Ar1 和 Ar2 分别代表一价芳香族基团；Y 代表包含芳香族基团的二价基团；W 代表具有 4 至 30 个碳原子的二价芳香族基团。