perfluoro-(2'-nitro-5'-phenyl-[1,1';3',1"]terphenyl) | 864970-06-9

• 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: perfluoro-(2'-nitro-5'-phenyl-[1,1';3',1"]terphenyl)
• 英文别名: 1,3-Difluoro-5-nitro-2,4,6-tris(2,3,4,5,6-pentafluorophenyl)benzene；1,3-difluoro-5-nitro-2,4,6-tris(2,3,4,5,6-pentafluorophenyl)benzene
• CAS: 864970-06-9
• 化学式: C₂₄F₁₇NO₂
• 分子量: 657.242
• InChiKey: CZMNXCKZQYUMMS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.3
• 重原子数：
  44
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  45.8
• 氢给体数：
  0
• 氢受体数：
  19

反应信息

• 作为产物：
  描述：

  五氟硝基苯 、 三甲基五氟苯基硅烷 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.0h， 以63%的产率得到nonafluoro-4-nitro-1,1'-biphenyl
  参考文献：
  名称：

  Formation of perfluorinated polyphenylenes by multiple pentafluorophenylation using C6F5Si(CH3)3

  摘要：

  Pentafluorophenylation of perfluoroarenes with C6F5Si(CH3)(3) was investigated by using NMR and MALDI-TOF-MS techniques. Successive multiple pentafluorophenylation easily occurred not only on the para-position but also on the ortho-positions to provide perfluorinated p-phenylene and m-phenylene compounds. The perfluoroarenes having electron-withdrawing substituents provided oligo- to poly-(phenylene)s depending on the added amounts of C6F5Si(CH3)(3), while the perfluoroarenes having electron-donor substituents gave H(C6F4)(n)F polymers produced from C6F5H, which was the decomposed product of C6F5Si(CH3)(3). (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2010.09.001