1,2,4,5-tetrakis(phenylamino)benzene | 80323-60-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1,2,4,5-tetrakis(phenylamino)benzene
• 英文别名: 1,2,4,5-tetrakis-(N-phenylamino)benzene；N¹,N²,N⁴,N⁵-tetraphenyl-benzene-1,2,4,5-tetrayltetraamine；N¹,N²,N⁴,N⁵-Tetraphenyl-benzen-1,2,4,5-tetrayltetraamin；Hydrazophenin；1.2.4.5-Tetraanilino-benzol；1-N,2-N,4-N,5-N-tetraphenylbenzene-1,2,4,5-tetramine
• CAS: 80323-60-0
• 化学式: C₃₀H₂₆N₄
• 分子量: 442.563
• InChiKey: RHOABAVXZPUCQZ-UHFFFAOYSA-N

物化性质

• 沸点：
  614.7±55.0 °C(Predicted)
• 密度：
  1.251±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  8.1
• 重原子数：
  34
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  48.1
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1,2,4,5-tetrakis(phenylamino)benzene 在 氧气 作用下， 以 氯仿 为溶剂， 反应 24.0h， 以94%的产率得到N,N'-二苯基-2,5-二(苯基氨基)-1,4-苯醌二亚胺
  参考文献：
  名称：

  An Azophenine Radical-Bridged Fe₂ Single-Molecule Magnet with Record Magnetic Exchange Coupling

  摘要：

  One-electron reduction of the complex [(TPyA)(2)Fe-2(II)(L-NPh(2-))](2+) (TPyA = tris(2-pyridylmethyl)-amine, (LH2)-L-NPh = azophenine = N,N',N '',N"'-tetraphenyl-2,5-diamino-1,4-diiminobenzoquinone) affords the complex [(TPyA)(2)Fe-2(II)(L-NPh(3-center dot))](+). X-ray diffraction and Mossbauer spectroscopy confirm that the reduction occurs on L-NPh(2-) to give an S = 1/2 radical bridging ligand. Dc magnetic susceptibility measurements demonstrate the presence of extremely strong direct antiferromagnetic exchange between S = 2 Fe-II centers and L-NPh(3-center dot) in the reduced complex, giving an S = 7/2 ground state with an estimated coupling constant magnitude of vertical bar J vertical bar >= 900 cm(-1). Mossbauer spectroscopy and ac magnetic susceptibility reveal that, this complex behaves as a single-molecule magnet with a spin relaxation barrier of U-eff = 50(1) cm(-1). To our knowledge, this complex exhibits by far the strongest magnetic exchange coupling ever to be observed in a single-molecule magnet.

  DOI：

  10.1021/ja409927v
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 ammonium sulfide 、 甲苯 作用下， 生成 1,2,4,5-tetrakis(phenylamino)benzene
  参考文献：
  名称：

  Fischer,O.; Hepp, Chemische Berichte, 1887, vol. 20, p. 2474

  摘要：

  DOI：

文献信息

• Syntheses and structures of benzo-bis(1,3,2-diazaboroles) and acenaphtho-1,3,2-diazaboroles
  作者：Lothar Weber、Daniel Eickhoff、Anna Chrostowska、Alain Dargelos、Clovis Darrigan、Hans-Georg Stammler、Beate Neumann

  DOI：10.1039/c9dt03818c

  日期：——

  hydride. Synthesis of the dark-red crystalline 2-bromo-N,N′-bis(diisopropylphenyl)acenaphtho-1,3,2-diazaborole 7 was effected by the cyclocondensation of 1,2-bis(N-2′,6′-diisopropylphenylimino)acenaphthene (5) and boron tribromide with subsequent sodium amalgam reduction of the initially formed burgundy red diazaborolium salt 6. Compounds 4, 6 and 7 are characterised by elemental analyses, 1H, 11B and

  无色结晶2,6-二溴-4,8-​​二甲基-1,3,5,7-四苯基苯并双（二氮杂硼烷）4是由3,6-二甲基-1,2,4,5-四苯基氨基苯3d与两个环缩合形成的当量在氢化钙存在下的三溴化硼。暗红色结晶的2-溴-N，N'-双（二异丙基苯基）ac-1,3,2-二氮杂硼酸酯7的合成是通过1,2-双（N -2'，6'-二异丙基苯基亚氨基）ac（5）和三溴化硼，随后形成最初的勃艮第红色重氮硼硼盐6的钠汞齐还原。化合物4，6元素分析，1 H，11 B和13 C NMR光谱，以及单X射线衍射研究，对7和7进行了表征。的电子结构4，6和7都受到DFT计算。
• Compounds for organic electroluminescent devices
  申请人：Merck Patent GmbH

  公开号：US10032992B2

  公开（公告）日：2018-07-24

  The present invention relates to boron compounds for use in electronic devices, especially organic electroluminescent devices, and to a process for preparing these compounds and to electronic devices, especially organic electroluminescent devices, comprising these compounds.

  本发明涉及用于电子器件，特别是有机电致发光器件的硼化合物，以及制备这些化合物的方法和包含这些化合物的电子器件，特别是有机电致发光器件。
• Dielectric films and materials therefor
  申请人：——

  公开号：US20040175858A1

  公开（公告）日：2004-09-09

  A material for dielectric films is a polymerizable composition containing an organic solvent, and an adamantanepolycarboxylic acid derivative represented by following Formula (1): 1 wherein X is hydrogen atom, a hydrocarbon group or R 4 ; R 1 , R 2 , R 3 and R 4 and are each independently a protected or unprotected carboxyl group, etc.; and Y 1 , Y 2 , Y 3 and Y 4 are each independently a single bond or a bivalent aromatic cyclic group; and an aromatic polyamine derivative represented by following Formula ( 2 ): 2 wherein Ring Z is a monocyclic or polycyclic aromatic ring; and R 5 , R 6 , R 7 and R 8 are each a substituent bound to Ring Z and are each independently a protected or unprotected amino group, etc., dissolved in the organic solvent.

  一种用于制备介电薄膜的材料是一种可聚合的组合物，包含有机溶剂和由以下式子（1）表示的金刚烷多羧酸衍生物：1其中X是氢原子、烃基或R4；R1、R2、R3和R4各自独立地是保护或未保护的羧基等；Y1、Y2、Y3和Y4各自独立地是单键或双价芳香环基团；以及由以下式子（2）表示的芳香族多胺衍生物：2其中环Z是单环或多环芳香环；R5、R6、R7和R8各自是结合在环Z上的取代基，各自独立地是保护或未保护的氨基等，溶解在有机溶剂中。
• COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES
  申请人：Merck Patent GmbH

  公开号：US20140361224A1

  公开（公告）日：2014-12-11

  The present invention relates to boron compounds for use in electronic devices, especially organic electroluminescent devices, and to a process for preparing these compounds and to electronic devices, especially organic electroluminescent devices, comprising these compounds.

  本发明涉及用于电子器件的硼化合物，特别是有机电致发光器件，并涉及制备这些化合物的方法以及包括这些化合物的电子器件，特别是有机电致发光器件。
• Dielectric films and materials thereof
  申请人：Daicel Chemical Industries, Ltd.

  公开号：EP1462471A1

  公开（公告）日：2004-09-29

  A material for dielectric films is a polymerizable composition containing an organic solvent, and an adamantanepolycarboxylic acid derivative represented by following Formula (1): wherein X is hydrogen atom, a hydrocarbon group or R4; R1, R2, R3 and R4 and are each independently a protected or unprotected carboxyl group, etc.; and Y1, Y2, Y3 and Y4 are each independently a single bond or a bivalent aromatic cyclic group; and an aromatic polyamine derivative represented by following Formula (2): wherein Ring Z is a monocyclic or polycyclic aromatic ring; and R5, R6, R7 and R8 are each a substituent bound to Ring Z and are each independently a protected or unprotected amino group, etc., dissolved in the organic solvent.

  一种用于电介质薄膜的材料是一种可聚合的组合物，其中含有一种有机溶剂和一种金刚烷聚羧酸衍生物，由下式（1）表示： 其中 X 为氢原子、烃基或 R4；R1、R2、R3 和 R4 各自独立地为受保护或未受保护的羧基等；Y1、Y2、Y3 和 Y4 各自独立地为单键或二价芳香环基；以及由下式（2）表示的芳香族多胺衍生物： 其中环 Z 是单环或多环芳香环；R5、R6、R7 和 R8 各自是与环 Z 结合的取代基，且各自独立地是受保护或未受保护的氨基等，溶解在有机溶剂中。