5-tert-butyl-2-diphenylaminoisophthalic acid dimethyl ester | 522739-60-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 5-tert-butyl-2-diphenylaminoisophthalic acid dimethyl ester
• 英文别名: 5-t-butyl-2-diphenylamino-isophthalic acid dimethyl ester；dimethyl 5-tert-butyl-2-(N-phenylanilino)benzene-1,3-dicarboxylate
• CAS: 522739-60-2
• 化学式: C₂₆H₂₇NO₄
• 分子量: 417.505
• InChiKey: GQWSHBXISFMVOQ-UHFFFAOYSA-N

物化性质

• 沸点：
  538.6±50.0 °C(Predicted)
• 密度：
  1.149±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  31
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  55.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  5-tert-butyl-2-diphenylaminoisophthalic acid dimethyl ester 在 盐酸 、 正丁基锂 、 溶剂黄146 作用下， 以 四氢呋喃 、 水 为溶剂， 反应 8.0h， 生成 7-t-butyl-5,5,9,9-tetra-p-tolyl-13b-aza-naphtho-[3,2,1-de]anthracene
  参考文献：
  名称：

  이형고리 화합물 및 이를 포함하는 유기전계발광소자

  摘要：

  This is the translation of the text you provided: This invention relates to a heterocyclic compound represented by the following [Chemical Formula 1] and an organic electroluminescent device including the same. The organic electroluminescent device according to the present invention exhibits excellent light-emitting characteristics such as driving voltage, lifespan, and efficiency. [Chemical Formula 1]

  公开号：

  KR102147425B1
• 作为产物：
  描述：

  2-溴-5-叔丁基苯-1,3-二羧酸 在 硫酸 、 铜 、 potassium carbonate 作用下， 以 二苯醚 为溶剂， 反应 66.0h， 生成 5-tert-butyl-2-diphenylaminoisophthalic acid dimethyl ester
  参考文献：
  名称：

  桥联的三芳基胺：一类新的杂螺旋体。

  摘要：

  使用简单的三步法合成了一系列桥联的三芳基胺，它们构成了一类新的杂螺旋体。这些化合物显示为高发光发色团并且能够被氧化。这些螺旋结构的固态结构显示出pi堆叠相互作用成为整体之字形图案的趋势。

  DOI：

  10.1021/jo026883p

文献信息

• Bridged triphenylamines as novel host materials for highly efficient blue and green phosphorescent OLEDs
  作者：Zuoquan Jiang、Yonghua Chen、Cong Fan、Chuluo Yang、Qi Wang、Youtian Tao、Zhiqiang Zhang、Jingui Qin、Dongge Ma

  DOI：10.1039/b902950h

  日期：——

  Two bridged triphenylamine–triphenylsilane (BTPASi) hybrids have been designed as host materials for phosphorescent OLEDs; devices with the novel host materials achieve maximum external quantum efficiencies as high as 15.4% for blue and 19.7% for green electrophosphorescence.

  两种桥联三苯胺-三苯基硅烷 (BTPASi) 杂化物被设计为磷光 OLED 的主体材料；采用新型基质材料的器件的蓝色电致磷光和绿色电致磷光的最大外量子效率分别高达 15.4% 和 19.7%。
• 이형고리 화합물 및 이를 포함하는 유기전계발광소자
  申请人：SFC CO., LTD. 에스에프씨 주식회사(120060087061) Corp. No ▼ 135511-0105889BRN ▼134-81-54429

  公开号：KR102147425B1

  公开（公告）日：2020-08-25

  본 발명은 하기 [화학식 1]로 표시되는 이형고리 화합물 및 이를 포함하는 유기전계발광소자로서, 본 발명에 따른 유기전계발광소자는 구동전압, 수명 및 효율 등의 발광 특성이 우수하다. [화학식 1]

  This is the translation of the text you provided: This invention relates to a heterocyclic compound represented by the following [Chemical Formula 1] and an organic electroluminescent device including the same. The organic electroluminescent device according to the present invention exhibits excellent light-emitting characteristics such as driving voltage, lifespan, and efficiency. [Chemical Formula 1]
• Bridged Triarylamines:  A New Class of Heterohelicenes
  作者：Jason E. Field、Thomas J. Hill、D. Venkataraman

  DOI：10.1021/jo026883p

  日期：2003.8.1

  A series of bridged triarylamines, which constitute a new class of heterohelicenes, have been synthesized using a simple three-step procedure. These compounds are shown to be highly luminescent chromophores and are capable of being oxidized. The solid-state structures of these helicenes show a tendency for pi-stacking interactions into an overall zigzag motif.

  使用简单的三步法合成了一系列桥联的三芳基胺，它们构成了一类新的杂螺旋体。这些化合物显示为高发光发色团并且能够被氧化。这些螺旋结构的固态结构显示出pi堆叠相互作用成为整体之字形图案的趋势。