1-n-butyl-1-ethylpyrrolidinium ethylsulfate | 1261240-45-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机硫酸及其衍生物
• 英文名称: 1-n-butyl-1-ethylpyrrolidinium ethylsulfate
• CAS: 1261240-45-2
• 化学式: C₂H₅O₄S*C₁₀H₂₂N
• 分子量: 281.417
• InChiKey: RBCMYORGLQTSOQ-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  18.0
• 可旋转键数：
  6.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  66.43
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  1-丁基吡咯烷 、 硫酸二乙酯 以 甲苯 为溶剂， 反应 20.0h， 以92%的产率得到1-n-butyl-1-ethylpyrrolidinium ethylsulfate
  参考文献：
  名称：

  Physicochemical Characterization of New Sulfate Ionic Liquids

  摘要：

  In this work, the ionic liquids 1-ethyl-1-methylpyrrolidinium ethylsulfate [EMpyr][ESO(4)], 1-n-butyl-1-ethylpyrrolidinium ethylsulfate [BEpyr][ESO(4)], 1-n-butyl-1-methylpyrrolidium methylsulfate [BMpyr][MSO(4)], and triethylmethylammonium methylsulfate [E(3)MN][MSO(4)] were synthesized, and their experimental densities, speeds of sound, dynamic viscosities, and refractive indices were studied as a function of temperature at atmospheric pressure. Thermal expansion coefficient, molar volume, and molar refraction of these ionic liquids were calculated from the experimental density and refractive index values. A thermal analysis for pyrrolidinium and ammonium-based ionic liquids at temperatures between T = (253.15 and 363.15) K is presented.

  DOI：

  10.1021/je1006357