N-hexyl-3,4-dihydroisoquinolinium bis(trifluoromethanesulfonyl)imide | 1392407-62-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氢异喹啉
• 英文名称: N-hexyl-3,4-dihydroisoquinolinium bis(trifluoromethanesulfonyl)imide
• 英文别名: [HDHQM][NTf2]；Bis(trifluoromethylsulfonyl)azanide;2-hexyl-3,4-dihydroisoquinolin-2-ium
• CAS: 1392407-62-3
• 化学式: C₂F₆NO₄S₂*C₁₅H₂₂N
• 分子量: 496.495
• InChiKey: FDUBIFGEJJIEPD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.31
• 重原子数：
  31
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  89
• 氢给体数：
  0
• 氢受体数：
  11

反应信息

• 作为产物：
  描述：

  异色满 在 氢溴酸 、 溴 作用下， 以 四氯化碳 、 乙醇 、 水 、 乙腈 为溶剂， 反应 20.0h， 生成 N-hexyl-3,4-dihydroisoquinolinium bis(trifluoromethanesulfonyl)imide
  参考文献：
  名称：

  N-Substituted 3,4-dihydroisoquinolinium ionic liquids as catalysts in alkenes epoxidation reactions

  摘要：

  Because of their high reactivity, epoxides are one of the most important groups of organic compounds. These substances are synthesised primarily by the catalytic oxidation of alkenes in the liquid or gaseous phase. This study investigated new catalytic systems for epoxidation reactions using functionalised ionic liquids. These ionic liquids serve as oxygen transfer agents during the reactions. Several N-substituted 3,4-dihydroisoquinolinium ionic liquids were synthesised, and their potential as catalysts for epoxidation reactions was investigated. Cyclic alkenes such as cyclohexene and cyclooctene were used as model olefins. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.apcata.2012.05.017
• 作为试剂：
  描述：

  环己烯 在 Oxone 、 N-hexyl-3,4-dihydroisoquinolinium bis(trifluoromethanesulfonyl)imide 、 四丁基硫酸氢铵 、 sodium carbonate 作用下， 以 水 、 乙腈 为溶剂， 反应 20.0h， 以73%的产率得到氧化环己烯
  参考文献：
  名称：

  N-Substituted 3,4-dihydroisoquinolinium ionic liquids as catalysts in alkenes epoxidation reactions

  摘要：

  Because of their high reactivity, epoxides are one of the most important groups of organic compounds. These substances are synthesised primarily by the catalytic oxidation of alkenes in the liquid or gaseous phase. This study investigated new catalytic systems for epoxidation reactions using functionalised ionic liquids. These ionic liquids serve as oxygen transfer agents during the reactions. Several N-substituted 3,4-dihydroisoquinolinium ionic liquids were synthesised, and their potential as catalysts for epoxidation reactions was investigated. Cyclic alkenes such as cyclohexene and cyclooctene were used as model olefins. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.apcata.2012.05.017

文献信息

• N-Substituted 3,4-dihydroisoquinolinium ionic liquids as catalysts in alkenes epoxidation reactions
  作者：Stefan Baj、Maciej Bełch、Mirosław Gibas

  DOI：10.1016/j.apcata.2012.05.017

  日期：2012.8

  Because of their high reactivity, epoxides are one of the most important groups of organic compounds. These substances are synthesised primarily by the catalytic oxidation of alkenes in the liquid or gaseous phase. This study investigated new catalytic systems for epoxidation reactions using functionalised ionic liquids. These ionic liquids serve as oxygen transfer agents during the reactions. Several N-substituted 3,4-dihydroisoquinolinium ionic liquids were synthesised, and their potential as catalysts for epoxidation reactions was investigated. Cyclic alkenes such as cyclohexene and cyclooctene were used as model olefins. (C) 2012 Elsevier B.V. All rights reserved.