2,2'-di-N,N'-diethylamino-3,3',5,5',6,6'-hexafluoro-4,4'-bipyridine | 1240503-67-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 2,2'-di-N,N'-diethylamino-3,3',5,5',6,6'-hexafluoro-4,4'-bipyridine
• CAS: 1240503-67-6
• 化学式: C₁₈H₂₀F₆N₄
• 分子量: 406.374
• InChiKey: RANVYHKNBARPTA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.67
• 重原子数：
  28.0
• 可旋转键数：
  7.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  32.26
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  二乙胺 、 octafluoro dipyridyl-(4,4') 以 乙醇 为溶剂， 反应 10.0h， 以50%的产率得到2,2'-di-N,N'-diethylamino-3,3',5,5',6,6'-hexafluoro-4,4'-bipyridine
  参考文献：
  名称：

  Octafluoro-4,4′-bipyridine and its derivatives: Synthesis, molecular and crystal structure

  摘要：

  The structure and chemical properties of perfluoro-4,4'-bipyridine have been studied. It was found that octafluoro-4,4'-bipyridine is a quite electron deficient system stable to the action of alkylating agents and sensitive to nucleophilic substitution of fluorine atoms. Depending on the reaction conditions and reagents used products could be obtained in which two and six fluorine atoms are substituted by nucleophiles. For all isolated compounds X-ray structure determination has been performed and the main peculiarities of the molecular and crystal structure of fluorine-containing bipyridines have been determined. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2009.11.022