N-hexadecyl-pyridinium trifluoromethanesulfonate | 1215070-78-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机磺酸及其衍生物
• 英文名称: N-hexadecyl-pyridinium trifluoromethanesulfonate
• 英文别名: 1-Hexadecylpyridin-1-ium;trifluoromethanesulfonate；1-hexadecylpyridin-1-ium;trifluoromethanesulfonate
• CAS: 1215070-78-2
• 化学式: CF₃O₃S*C₂₁H₃₈N
• 分子量: 453.61
• InChiKey: JSFBQKCEDKMIRL-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  6.51
• 重原子数：
  30.0
• 可旋转键数：
  15.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  61.08
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  potassium trifluoromethansulfonate 、 溴代十六烷基吡啶 反应 0.25h， 生成 N-hexadecyl-pyridinium trifluoromethanesulfonate
  参考文献：
  名称：

  Synthesis of imidazolium and pyridinium-based ionic liquids and application of 1-alkyl-3-methylimidazolium salts as pre-catalysts for the benzoin condensation using solvent-free and microwave activation

  摘要：

  An efficient one-pot procedure for the synthesis of ionic liquids based on nitrogen-containing heterocycles, imidazolium or pyridinium under 'green chemistry' conditions has been described Imidazolium salts and DBU have been found to catalyze efficiently the berizoin condensation giving good yields within very short reaction time using solvent-free microwave activation conditions (C) 2009 Elsevier Ltd All rights reserved

  DOI：

  10.1016/j.tet.2009.11.110