N-乙基-N-[4-(1H-1,2,4-三唑-3-基偶氮)苯基]苄胺 | 13486-13-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: N-乙基-N-[4-(1H-1,2,4-三唑-3-基偶氮)苯基]苄胺
• 英文名称: Benzenemethanamine, N-ethyl-N-[4-(1H-1,2,4-triazol-3-ylazo)phenyl]-
• 英文别名: N-benzyl-N-ethyl-4-(1H-1,2,4-triazol-5-yldiazenyl)aniline
• CAS: 13486-13-0
• 化学式: C₁₇H₁₈N₆
• 分子量: 306.37
• InChiKey: CAAQCABQPNOOQQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  69.5
• 氢给体数：
  1
• 氢受体数：
  5

安全信息

• 海关编码：
  2933990090

反应信息

• 作为产物：
  描述：

  3-氨基-1,2,4-三氮唑 、 N-乙基-N-苄基苯胺 在 nitrosyl sulfuric acid 作用下， 以 溶剂黄146 、 丙酸 、 乙腈 为溶剂， 反应 3.0h， 以91%的产率得到N-乙基-N-[4-(1H-1,2,4-三唑-3-基偶氮)苯基]苄胺
  参考文献：
  名称：

  Novel azo disperse dyes derived from N-benzyl–N-ethyl–aniline: Synthesis, solvatochromic and optical properties

  摘要：

  Seven new azo disperse dyes based on N-benzyl-N-ethyl-aniline were synthesized and characterized by UV-Vis, FT-IR and H-1 NMR spectroscopic techniques. The UV-visible studies and solvatochromic behavior of all dyes in 15 solvents with different polarity were examined and a meaningful correlation was observed. In the optical characterization of dyes using Z-Scan experiment, thin films of polymethyl metacrylate doped with guest synthesized chromophores 2, 3, 4 and 7 were investigated. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molliq.2009.11.010

文献信息

• Novel azo disperse dyes derived from N-benzyl–N-ethyl–aniline: Synthesis, solvatochromic and optical properties
  作者：M.R. Yazdanbakhsh、A. Mohammadi、E. Mohajerani、H. Nemati、N. Hosain Nataj、A. Moheghi、E. Naeemikhah

  DOI：10.1016/j.molliq.2009.11.010

  日期：2010.2

  Seven new azo disperse dyes based on N-benzyl-N-ethyl-aniline were synthesized and characterized by UV-Vis, FT-IR and H-1 NMR spectroscopic techniques. The UV-visible studies and solvatochromic behavior of all dyes in 15 solvents with different polarity were examined and a meaningful correlation was observed. In the optical characterization of dyes using Z-Scan experiment, thin films of polymethyl metacrylate doped with guest synthesized chromophores 2, 3, 4 and 7 were investigated. (C) 2009 Elsevier B.V. All rights reserved.