5,5'-(bis[4-di(4-bromophenyl)amino]phenyl)-2,2'-bithiophene | 203381-34-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 5,5'-(bis[4-di(4-bromophenyl)amino]phenyl)-2,2'-bithiophene
• 英文别名: 4-[5-[5-[4-(4-bromo-N-(4-bromophenyl)anilino)phenyl]thiophen-2-yl]thiophen-2-yl]-N,N-bis(4-bromophenyl)aniline
• CAS: 203381-34-4
• 化学式: C₄₄H₂₈Br₄N₂S₂
• 分子量: 968.468
• InChiKey: POPNYAXHOWKUMO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  15.5
• 重原子数：
  52
• 可旋转键数：
  9
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  63
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  5,5'-(bis[4-di(4-bromophenyl)amino]phenyl)-2,2'-bithiophene 在 nitrosyl hexafluorophosphate 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Thienyl Triarylamines. Reactivity and Spectra of Cation Radicals and Dications.

  摘要：

  The alpha-thienyl substituted triarylamines, bis(4-bromophenyl)-4-(2-thienyl)-phenylamine (1), (4-bromophenyl)bis-[4-(2-thienyl)phenyl]amine (2) and tris[4-(2-thienyl)phenyl]amine (3) were prepared as novel molecular systems for photoelectrical conversion. Electrochemical oxidations using solvents like hexafluoroisopropanol were performed to evaluate the stability of the corresponding cation radicals. The dimer 5,5'-{bis[4-di(4-bromophenyl)amino]phenyl}-2,2'-bithiophene (1D) was prepared by an electrochemical oxidation-reduction sequence. Chemical and electrochemical oxidations of 1D were studied and UV-VIS-NIR spectra of the neutral, cation radical and dication are reported.

  DOI：

  10.3891/acta.chem.scand.52-0131
• 作为产物：
  描述：

  bis(4-bromophenyl)-4-(2-thienyl)phenylamine 在 lithium perchlorate 作用下， 以 乙腈 为溶剂， 以71%的产率得到5,5'-(bis[4-di(4-bromophenyl)amino]phenyl)-2,2'-bithiophene
  参考文献：
  名称：

  Thienyl Triarylamines. Reactivity and Spectra of Cation Radicals and Dications.

  摘要：

  The alpha-thienyl substituted triarylamines, bis(4-bromophenyl)-4-(2-thienyl)-phenylamine (1), (4-bromophenyl)bis-[4-(2-thienyl)phenyl]amine (2) and tris[4-(2-thienyl)phenyl]amine (3) were prepared as novel molecular systems for photoelectrical conversion. Electrochemical oxidations using solvents like hexafluoroisopropanol were performed to evaluate the stability of the corresponding cation radicals. The dimer 5,5'-{bis[4-di(4-bromophenyl)amino]phenyl}-2,2'-bithiophene (1D) was prepared by an electrochemical oxidation-reduction sequence. Chemical and electrochemical oxidations of 1D were studied and UV-VIS-NIR spectra of the neutral, cation radical and dication are reported.

  DOI：

  10.3891/acta.chem.scand.52-0131