1-chloro-2,4-dinitro-5-(phenylamino)benzene | 91331-44-1

• 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: 1-chloro-2,4-dinitro-5-(phenylamino)benzene
• 英文别名: 5-chloro-2,4-dinitro-N-phenylaniline；(5-chloro-2,4-dinitro-phenyl)-phenyl-amine；(5-Chlor-2,4-dinitro-phenyl)-phenyl-amin；N-Phenyl-5-chlor-2.4-dinitro-anilin；5-Chlor-2.4-dinitro-diphenylamin；N-phenyl-5-chloro-2,4-dinitroaniline
• CAS: 91331-44-1
• 化学式: C₁₂H₈ClN₃O₄
• 分子量: 293.666
• InChiKey: UWYTXOKQQLOQDW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  20
• 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：
  104
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  1-chloro-2,4-dinitro-5-(phenylamino)benzene 在 盐酸 、 溶剂黄146 、 tin(ll) chloride 作用下， 生成 5-chloro-N¹-phenyl-benzene-1,2,4-triyltriamine
  参考文献：
  名称：

  Fries, Justus Liebigs Annalen der Chemie, 1927, vol. 454, p. 204

  摘要：

  DOI：
• 作为产物：
  描述：

  1,3-二氯苯 在 乙醇 、 硫酸 、 硝酸 作用下， 生成 1-chloro-2,4-dinitro-5-(phenylamino)benzene
  参考文献：
  名称：

  Nietzki; Schedler, Chemische Berichte, 1897, vol. 30, p. 1667

  摘要：

  DOI：

文献信息

• Oxidative nucleophilic aromatic amination of nitrobenzenes
  作者：V. V. Khutorianskyi、M. Sonawane、M. Pošta、B. Klepetářová、P. Beier

  DOI：10.1039/c6cc02235a

  日期：——

  Regioselective oxidative nucleophilic substitution of aromatic hydrogen of substituted nitrobenzenes with lithium salts of arylamines is described. The method allows the synthesis of a variety of N-aryl-2-nitroanilines.

  描述了用芳基胺的锂盐对取代的硝基苯的芳族氢进行区域选择性氧化亲核取代。该方法允许合成多种N-芳基-2-硝基苯胺。
• Modular Fluorescent Benzobis(imidazolium) Salts:  Syntheses, Photophysical Analyses, and Applications
  作者：Andrew J. Boydston、Peter D. Vu、Olga L. Dykhno、Vicki Chang、Alvin R. Wyatt、Adam S. Stockett、Eric T. Ritschdorff、Jason B. Shear、Christopher W. Bielawski

  DOI：10.1021/ja7102247

  日期：2008.3.1

  A series of benzobis(imidazolium) (BBI) salts has been prepared and studied as a new class of versatile fluorescent materials. Using a high yielding, modular synthetic strategy, 13131 salts with a range of functionality poised for investigating fundamental and applications-oriented characteristics, including emission wavelength tunability, solvatochromism, red-edge excitation, chemical stability, multiphoton excitation, and protein conjugation, were prepared in overall yields of 40-97%. Through structural variation, the BBIs exhibited lambda(em) ranging between 329 and 561 nm while displaying Phi(f)s up to 0.91. In addition, the emission characteristics of these salts were found to exhibit strong solvent dependencies with Stokes shifts ranging from 4570 to 13 793 cm(-1), depending on the nature of the BBI core. Although red-edge effects for BBI salts with Br and BF4 counterions were found to be similar, unique characteristics were displayed by an analogue with MeSO4 anions. The stability of an amphiphilic BBI was quantified in aqueous solutions of varying pH, and > 85% of the emission intensity was retained after 2 h at pH 3-9. Through multiphoton excitation experiments in aqueous solutions, a BBI salt was found to exhibit three-photon fluorescence action cross sections similar to serotonin. The application of BBI salts as fluorescent protein tags was demonstrated by conjugating bovine serum albumin to a maleimide-functionalized derivative.
• Borsche, Chemische Berichte, 1917, vol. 50, p. 1354
  作者：Borsche

  DOI：——

  日期：——
• US4033945A
  申请人：——

  公开号：US4033945A

  公开（公告）日：1977-07-05
• US4137228A
  申请人：——

  公开号：US4137228A

  公开（公告）日：1979-01-30