chloranil-anthracene | 3706-14-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 并四苯
• 英文名称: chloranil-anthracene
• CAS: 3706-14-7
• 化学式: C₆Cl₄O₂*C₁₄H₁₀
• 分子量: 424.11
• InChiKey: QGEIINNETQQVKO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.51
• 重原子数：
  26.0
• 可旋转键数：
  0.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  34.14
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  chloranil-anthracene 以 二氯甲烷 为溶剂， 生成 蒽 、 四氯苯醌
  参考文献：
  名称：

  Charge transfer complex formation between p-chloranil and 1,n-di(9-anthryl)alkanes

  摘要：

  Dimer model compounds of polyvinylanthracenes (1,n-di(9-anthryl)alkanes, when n = 1-5) were synthesized to model the effects of distance and orientation between anthracene groups in polymeric systems. Charge transfer (CT) complexes of anthracene, 9-methylanthracene and 1,n-di(9-anthryl)alkanes with p-chloranil (p-CHL) have been investigated spectrophotometrically in dichloromethane. The colored products are measured spectrophotometrically at different wavelength depending on the electronic transition between donors and acceptor. The formation constants of the CT complexes were determined by the Benesi-Hildebrand equation. The thermodynamic parameters were calculated by Van't Hoff equation. Stochiometries of the complexes formed between donors and acceptor were defined by the Job's method of the continuous variation and found in 1:1 complexation with donor and acceptor at the maximum absorption bands. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2005.07.073
• 作为产物：
  描述：

  蒽 、 四氯苯醌 以 二氯甲烷 为溶剂， 生成 chloranil-anthracene
  参考文献：
  名称：

  Charge transfer complex formation between p-chloranil and 1,n-di(9-anthryl)alkanes

  摘要：

  Dimer model compounds of polyvinylanthracenes (1,n-di(9-anthryl)alkanes, when n = 1-5) were synthesized to model the effects of distance and orientation between anthracene groups in polymeric systems. Charge transfer (CT) complexes of anthracene, 9-methylanthracene and 1,n-di(9-anthryl)alkanes with p-chloranil (p-CHL) have been investigated spectrophotometrically in dichloromethane. The colored products are measured spectrophotometrically at different wavelength depending on the electronic transition between donors and acceptor. The formation constants of the CT complexes were determined by the Benesi-Hildebrand equation. The thermodynamic parameters were calculated by Van't Hoff equation. Stochiometries of the complexes formed between donors and acceptor were defined by the Job's method of the continuous variation and found in 1:1 complexation with donor and acceptor at the maximum absorption bands. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2005.07.073

文献信息

• Das, Aloke Kumar; Basu, Rama, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1983, vol. 22, # 10, p. 845 - 852
  作者：Das, Aloke Kumar、Basu, Rama

  DOI：——

  日期：——