对(对硝基苯乙烯基)苯胺 | 4629-58-7

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 中文名称: 对(对硝基苯乙烯基)苯胺
• 英文名称: 4-amino-4'-nitrostilbene
• 英文别名: 4-[2-(4-Nitrophenyl)ethenyl]aniline
• CAS: 4629-58-7
• 化学式: C₁₄H₁₂N₂O₂
• mdl: MFCD00441443
• 分子量: 240.261
• InChiKey: CHIJEKAVDZLCJA-UHFFFAOYSA-N

物化性质

• 沸点：
  382.97°C (rough estimate)
• 密度：
  1.1613 (rough estimate)

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  71.8
• 氢给体数：
  1
• 氢受体数：
  3

安全信息

• 海关编码：
  2921420090

反应信息

• 作为反应物：
  描述：

  4-癸氧基苯甲醛 、 对(对硝基苯乙烯基)苯胺 以 乙醇 为溶剂， 反应 6.0h， 以85%的产率得到
  参考文献：
  名称：

  Contribution of stilbene-imine additives on the structural, ionic conductivity performance and theoretical evaluation on CMC-based biopolymer electrolytes

  摘要：

  New solid biopolymer electrolytes (SBEs) were prepared by integrating stilbene-imine derivatives bearing vinylene (-CH-CH-) and azomethine (-CH-N-) as additives in carboxymethyl cellulose (CMC) based electrolyte. The investigation on their spectroscopic and theoretical assessments were conducted to alter the energy level in improving the structural and ionic conductivity performance. The simulated results from frontier molecular orbitals (FMO) and Mulliken-charge analysis revealed that -CF3 and -NO2 substituents significantly reduce the HOMO-LUMO gap up to 0.68 eV. The highest ionic conductivity of SBEs achieved at ambient tem-perature was similar to 8 x 10(-3) Scm(-1) upon the addition of additive, obeying an Arrhenius model with reciprocal of temperature (303 K-373 K). The coordination interaction of C-O bond and CH=N band facilitated the dissociation of more cation (H+) of NH4Cl which permits alternative route for H+ to hop into coordinating site in CMC. The outcomes are ideal in the development of electrochemical devices.

  DOI：

  10.1016/j.carbpol.2020.116935
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 ammonium sulfide 作用下， 生成 对(对硝基苯乙烯基)苯胺
  参考文献：
  名称：

  Strakosch, Chemische Berichte, 1873, vol. 6, p. 329

  摘要：

  DOI：
• 作为试剂：
  描述：

  trans-4,4'-dinitrostilbene 、 氯化亚锡 、 sodium hydroxide 在 乙酸乙酯 、 水 、 Brine 、 Sodium sulfate-III 、 对(对硝基苯乙烯基)苯胺 作用下， 以 四氢呋喃 、 盐酸 为溶剂， 反应 16.0h， 以yielded 4,4′-diamino-trans-stilbene (3, 0.03 g, 40%) and 4-[2-(4-nitro-phenyl)-vinyl]-phenylamine (4)的产率得到(E)-4-(对氨基苯)乙烯
  参考文献：
  名称：

  MOLECULAR PROBES FOR DETECTING LIPID COMPOSITION

  摘要：

  一种检测受试者髓鞘的方法，包括向受试者施加一种分子探针，该探针包括一种荧光转-史蒂本衍生物，并检测受试者感兴趣的组织中分子探针的数量或分布。

  公开号：

  US20140079635A1

文献信息

• 一种二苯乙烯类化合物的制备方法
  申请人：东南大学

  公开号：CN104591959B

  公开（公告）日：2016-11-02

  本发明提供了一种二苯乙烯类化合物的制备方法，以氯化胆碱和酰胺所形成的低共熔溶剂作为反应溶剂，在碱催化下，以取代或无取代的苄基膦酸二乙酯和取代或无取代的苯甲醛为原料经Wittig‑Horner反应,制得二苯乙烯类化合物。本发明提供采用氯化胆碱和酰胺所形成的低共熔溶剂作为反应溶剂，该溶剂适用于二苯乙烯类化合物的合成，具有通用性好、反应条件温和、操作方便、成本低、环境友好等优点，适于工业化生产。
• Contribution of stilbene-imine additives on the structural, ionic conductivity performance and theoretical evaluation on CMC-based biopolymer electrolytes
  作者：Rafizah Rahamathullah、Wan M. Khairul、M.I.N Isa

  DOI：10.1016/j.carbpol.2020.116935

  日期：2020.12

  New solid biopolymer electrolytes (SBEs) were prepared by integrating stilbene-imine derivatives bearing vinylene (-CH-CH-) and azomethine (-CH-N-) as additives in carboxymethyl cellulose (CMC) based electrolyte. The investigation on their spectroscopic and theoretical assessments were conducted to alter the energy level in improving the structural and ionic conductivity performance. The simulated results from frontier molecular orbitals (FMO) and Mulliken-charge analysis revealed that -CF3 and -NO2 substituents significantly reduce the HOMO-LUMO gap up to 0.68 eV. The highest ionic conductivity of SBEs achieved at ambient tem-perature was similar to 8 x 10(-3) Scm(-1) upon the addition of additive, obeying an Arrhenius model with reciprocal of temperature (303 K-373 K). The coordination interaction of C-O bond and CH=N band facilitated the dissociation of more cation (H+) of NH4Cl which permits alternative route for H+ to hop into coordinating site in CMC. The outcomes are ideal in the development of electrochemical devices.
• Strakosch, Chemische Berichte, 1873, vol. 6, p. 329
  作者：Strakosch

  DOI：——

  日期：——