bis-3,3’,5,5’-tetra-tert-butyldiphenylamine | 37055-49-5

• 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: bis-3,3’,5,5’-tetra-tert-butyldiphenylamine
• 英文别名: Bis-(3,5-di-t-butylphenyl)amin；3,5-ditert-butyl-N-(3,5-ditert-butylphenyl)aniline
• CAS: 37055-49-5
• 化学式: C₂₈H₄₃N
• 分子量: 393.656
• InChiKey: RPBTURXQUMQCJP-UHFFFAOYSA-N

物化性质

• 沸点：
  427.9±45.0 °C(Predicted)
• 密度：
  0.932±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  10.2
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  12
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  bis-3,3’,5,5’-tetra-tert-butyldiphenylamine 在 亚硝酸钠-15N 作用下， 以98%的产率得到N,N-bis(3,5-ditert-butylphenyl)(15N)nitrous amide
  参考文献：
  名称：

  Crasovschi, Afanase; Grecu, Nicoleta; Negoita, Nicolae, Revue Roumaine de Chimie, 1992, vol. 37, # 11-12, p. 1335 - 1340

  摘要：

  DOI：
• 作为产物：
  描述：

  3,5-二叔丁基甲苯 在 potassium permanganate 作用下， 以 吡啶 为溶剂， 生成 bis-3,3’,5,5’-tetra-tert-butyldiphenylamine
  参考文献：
  名称：

  Crasovschi, Afanase; Grecu, Nicoleta; Negoita, Nicolae, Revue Roumaine de Chimie, 1992, vol. 37, # 11-12, p. 1335 - 1340

  摘要：

  DOI：

文献信息

• METAPHENYLENE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME
  申请人：Ohuchi Kazuei

  公开号：US20110272686A1

  公开（公告）日：2011-11-10

  A polymer compound comprising a constitutional unit represented by the following formula (2) and a constitutional unit represented by the following formula (1), wherein R 1 represents an alkyl group or the like, and R 2 and R 3 each independently represent a hydrogen atom or the like, -Ar 1 -  (2) wherein Ar 1 represents an arylene group or the like. A hydrogen atom in the group represented by Ar 1 may be substituted by an alkyl group, aryl group or the like.

  一种聚合物化合物，包括由以下化学式（2）表示的构造单元和由以下化学式（1）表示的构造单元，其中R1代表烷基基团或类似物，R2和R3各自独立地代表氢原子或类似物，-Ar1-（2），其中Ar1代表芳基基团或类似物。在由Ar1表示的基团中，氢原子可以被烷基基团、芳基团或类似物替代。
• NOVEL COMPOUND AND METHOD FOR PRODUCING SAME
  申请人：Sumitomo Chemical Company, Limited

  公开号：US20200140394A1

  公开（公告）日：2020-05-07

  A compound represented by the formula (1) is provided: wherein A 1 represents an oxygen atom, a sulfur atom, —NR 5 — or —PR 5 —; at least one A 1 is —NR 5 — or —PR 5 —; R 1 represents a hydrogen atom, an alkyl group, a cycloalkyl group, an alkoxy group, a cycloalkoxy group, an aryloxy group, an alkylsulfenyl group, a cycloalkylsulfenyl group, an arylsulfenyl group or a disubstituted amino group; R 2 and R 3 represent an alkyl group, a cycloalkyl group, an aryl group, an alkoxy group, a cycloalkoxy group, an aryloxy group, an alkylsulfenyl group, a cycloalkylsulfenyl group, an arylsulfenyl group, a monovalent heterocyclic group, a halogen atom or a disubstituted amino group; R 4 represents a hydrogen atom, —C(R 6 ) 3 , —OR 7 , —N(R 7 ) 2 or —Si(R 7 ) 3 ; m represents an integer of 0 to 3; and n represents an integer of 0 to 4.

  提供了一个由以下公式表示的化合物：其中A1代表氧原子、硫原子、—NR5—或—PR5—；至少一个A1是—NR5—或—PR5—；R1代表氢原子、烷基基团、环烷基基团、烷氧基团、环烷氧基团、芳基氧基团、烷基硫基团、环烷基硫基团、芳基硫基团或二取代氨基团；R2和R3代表烷基基团、环烷基基团、芳基、烷氧基团、环烷氧基团、芳基氧基团、烷基硫基团、环烷基硫基团、芳基硫基团、一价杂环基团、卤素原子或二取代氨基团；R4代表氢原子、—C(R6)3、—OR7、—N(R7)2或—Si(R7)3；m代表0到3的整数；n代表0到4的整数。
• METAL COMPLEX, COMPOSITION AND LIGHT EMITTING DEVICE
  申请人：Sumitomo Chemical Company, Limited

  公开号：US20190185500A1

  公开（公告）日：2019-06-20

  A metal complex represented by formula (1) is provided. In formula (1), X represents a nitrogen atom or a group represented by ═C(R X )—; R 1 represents an alkyl group having 4 or more carbon atoms; R 2 represents an alkyl, cycloalkyl, alkoxy, cycloalkoxy, aryl, aryloxy, monovalent heterocyclic, or substituted amino group or a halogen atom; rings A and B each independently represent an aromatic hydrocarbon ring or an aromatic heterocyclic ring; M represents a rhodium, palladium, iridium, or platinum atom; n 1 represents an integer of 1 or more, n 2 represents an integer of 0 or more, and n 1 +n 2 is 2 or 3; A 1 -G 1 -A 2 represents an anionic bidentate ligand; A 1 and A 2 each independently represent a carbon atom, an oxygen atom, or a nitrogen atom; and G 1 represents a single bond or an atomic group constituting a bidentate ligand together with A 1 and A 2 .

  提供了由式（1）表示的金属配合物。在式（1）中，X代表氮原子或由 ═C(RX)— 表示的基团；R1代表具有4个或更多碳原子的烷基基团；R2代表烷基、环烷基、烷氧基、环烷氧基、芳基、芳氧基、一价杂环基、或取代氨基或卤素原子；环A和环B各自独立地代表芳香烃环或芳香杂环；M代表铑、钯、铱或铂原子；n1代表1或更多的整数，n2代表0或更多的整数，且n1+n2为2或3；A1-G1-A2代表阴离子双齿配体；A1和A2各自独立地代表碳原子、氧原子或氮原子；G1代表单键或与A1和A2一起构成双齿配体的原子团。
• METAL COMPLEX AND LIGHT EMITTING DEVICE USING THE SAME
  申请人：Sumitomo Chemical Company, Limited

  公开号：US20170166599A1

  公开（公告）日：2017-06-15

  Provided is a metal complex excellent in light emission stability. The metal complex is represented by the formula (1): wherein M represents an iridium atom or the like, n 1 represents an integer of 1 to 3, n 2 represents an integer of 0 to 2, E 2 to E 4 represent a nitrogen atom or a carbon atom where two selected from among E 2 to E 4 are nitrogen atoms and the remaining one is a carbon atom, R 1 represents an aryl group or the like, R 2 and R 3 represent a hydrogen atom, an alkyl group, an aryl group or the like, the ring B represents a triazole ring, the ring A represents an aromatic hydrocarbon ring or the like, and A 1 -G 1 -A 2 represents an anionic bidentate ligand.

  提供的是一种在发光稳定性方面表现出色的金属配合物。该金属配合物由以下式表示：其中M代表铱原子或类似物，n1代表1到3的整数，n2代表0到2的整数，E2到E4代表氮原子或碳原子，其中E2到E4中选取两个为氮原子，另一个为碳原子，R1代表芳基或类似物，R2和R3代表氢原子、烷基、芳基或类似物，环B代表三唑环，环A代表芳香烃环或类似物，A1-G1-A2代表一个阴离子双齿配体。
• COMPOSITION AND LIGHT-EMITTING DEVICE USING THE SAME
  申请人：Sumitomo Chemical Company, Limited

  公开号：US20180354978A1

  公开（公告）日：2018-12-13

  A composition containing phosphorescent compounds represented by formula (1) and formula (2) are provided. M 1 and M 2 each represent an iridium atom, n 1 and n 3 each denote an integer of 1 or more; n and n 4 each denote an integer of 0 or more, n 1 +n 2 and n 3 +n 4 are each 2 or 3, E L represents a hydrogen atom or a nitrogen atom, R 2 represents an aromatic hydrocarbon ring, E 1 , E 2 , E 11A , and E 12A represent a nitrogen atom, R 11A , R 12A , and R 13A represent an aryl group, ring L 1 represents a 6-membered aromatic heterocyclic ring, ring L 2 represents an aromatic hydrocarbon ring, at least ring L 1 or ring L 2 has a group represented by formula (1-T), A 1 -G 1 -A 2 and A 3 -G 2 -A 4 each represent an anionic bidentate ligand, A 1 , A 2 , A 3 and A 4 each represent a nitrogen atom, G 1 and G 2 each represent a single bond, and R 1T represents an alkyl group. —R 1T (1-T)

  提供了一个包含磷光化合物的组合物，其表示为公式（1）和公式（2）。M1和M2分别代表一个铱原子，n1和n3分别表示大于或等于1的整数；n和n4分别表示大于或等于0的整数，n1+n2和n3+n4分别为2或3，EL代表一个氢原子或一个氮原子，R2代表一个芳香烃环，E1、E2、E11A和E12A代表一个氮原子，R11A、R12A和R13A代表一个芳基团，环L1代表一个6元芳香杂环，环L2代表一个芳香烃环，至少环L1或环L2具有一个由公式（1-T）表示的基团，A1-G1-A2和A3-G2-A4分别代表一个阴离子双齿配体，A1、A2、A3和A4分别代表一个氮原子，G1和G2分别代表一个单键，R1T代表一个烷基团。—R1T(1-T)