1,3,7-trimethylisoquinoline | 73480-88-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 1,3,7-trimethylisoquinoline
• CAS: 73480-88-3
• 化学式: C₁₂H₁₃N
• 分子量: 171.242
• InChiKey: GWHAQUUUZHTFPR-UHFFFAOYSA-N

物化性质

• 沸点：
  262.9±9.0 °C(Predicted)
• 密度：
  1.034±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  12.9
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  (E)-3-Methyl-4-p-tolyl-but-3-en-2-one oxime 在 五氯化磷 、 phosphorus pentoxide 作用下， 生成 1,3,7-trimethylisoquinoline
  参考文献：
  名称：

  A Simple Preparation of 1,3-Dimethylisoquinoline and its Derivatives

  摘要：

  DOI：

  10.1055/s-1980-28962

文献信息

• Rh-catalyzed sequential oxidative C–H activation/annulation with geminal-substituted vinyl acetates to access isoquinolines
  作者：Haoke Chu、Song Sun、Jin-Tao Yu、Jiang Cheng

  DOI：10.1039/c5cc04708k

  日期：——

  The concise synthesis of 3-substituted or non-C3-substituted isoquinolines through Rh-catalyzed sequential oxidative C-H activation/annulation with geminal-substituted vinyl acetates was developed.

  开发了通过双键取代的乙酸乙烯酯通过Rh催化的连续氧化CH活化/环化反应，可以精确合成3-取代或非C3-取代的异喹啉的方法。
• Zielinski, Wojciech, Polish Journal of Chemistry, 1982, vol. 56, # 1, p. 93 - 100
  作者：Zielinski, Wojciech

  DOI：——

  日期：——
• ZIELINSKI, W., POL. J. CHEM., 1982, 56, N 1, 93-100
  作者：ZIELINSKI, W.

  DOI：——

  日期：——
• ORGANIC ELECTRIC FIELD LIGHT EMITTING ELEMENT AND PRODUCTION THEREFOR
  申请人：Yabe Masayoshi

  公开号：US20090066223A1

  公开（公告）日：2009-03-12

  A composition for an organic electroluminescent device is a composition for forming an organic light emitting layer of an organic electroluminescent device by wet coating process. The composition contains a phosphorescent material, a charge transport material, and a solvent, in which the phosphorescent material and the charge transport material are each an unpolymerized organic compound, and the first oxidation potential of the phosphorescent material E D + , the first reduction potential of the phosphorescent material E D − , the first oxidation potential of the charge transporting material E T + , and the first reduction potential of the charge transporting material E T − satisfy the following condition: E T − +0.1≦E D −
• ORGANIC LIGHT-EMITTING DEVICE
  申请人：SAMSUNG DISPLAY CO., LTD.

  公开号：US20160141519A1

  公开（公告）日：2016-05-19

  An organic light-emitting device includes an organic layer including an emission layer between a first electrode and the second electrode, and a hole transport region including an auxiliary layer between the first electrode and the emission layer, the hole transport region. The auxiliary layer includes a first material and a second material that satisfy Equations 1-1 and 1-2: 0 eV< E L2 −E L1 ≦0.6 eV   0 eV< E H1 −E H2 ≦0.6 eV   wherein in Equation 1-1 and 1-2, E H1 is a highest occupied molecular orbital energy (HOMO energy) of the first material; E L1 is a lowest unoccupied molecular orbital energy (LUMO energy) of the first material; E H2 is a HOMO energy of the second material; and E L2 is a LUMO energy of the second material.