L-1-methyl-3-(1'-hydroxy-2'-propanyl)imidazolium trifluoromethanesulfonate | 1207753-48-7

• 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: L-1-methyl-3-(1'-hydroxy-2'-propanyl)imidazolium trifluoromethanesulfonate
• 英文别名: [mhypim][OTf]
• CAS: 1207753-48-7
• 化学式: CF₃O₃S*C₇H₁₃N₂O
• 分子量: 290.263
• InChiKey: LCLNRKUKOJBVEN-FJXQXJEOSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -0.08
• 重原子数：
  18.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  86.24
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  三氟甲烷磺酸甲酯 、 (2S)-2-(1H-咪唑-1-基)-1-丙醇 反应 24.0h， 生成 L-1-methyl-3-(1'-hydroxy-2'-propanyl)imidazolium trifluoromethanesulfonate
  参考文献：
  名称：

  Erbium triflate in ionic liquids: A recyclable system of improving selectivity in Diels–Alder reactions

  摘要：

  The efficiency of Er(OTf)(3) in promoting the Diels-Alder reactions between different dienes and dienophiles in ionic liquids has been investigated. Compared with the analogous cycloadditions performed in conventional solvents shorter reaction times are required to obtain good/excellent yields. In most cases an enhancement of regio- and endo:exo selectivity was observed. The role of the ionic liquid, as a function of the cationic part, i.e. the imidazolium based or the pyridinium based, is discussed well. The ILs containing the catalyst can be readily separated from the reaction products and recovered in very high purity for direct reuse, up to six cycles. (C) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.apcata.2009.10.020