[Benz-SO3Hmim][Cl] | 1379371-68-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [Benz-SO3Hmim][Cl]
• CAS: 1379371-68-2
• 化学式: C₁₁H₁₃N₂O₃S*Cl
• 分子量: 288.755
• InChiKey: FHLWJUQCISSGSP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.39
• 重原子数：
  18.0
• 可旋转键数：
  3.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  63.18
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  1-苄基-3-甲基咪唑氯盐 在 氯磺酸 作用下， 以 二氯甲烷 为溶剂， 反应 12.0h， 以81%的产率得到[Benz-SO3Hmim][Cl]
  参考文献：
  名称：

  Influence of –SO3H functionalization (N-SO3H or N-R-SO3H, where R=alkyl/benzyl) on the activity of Brönsted acidic ionic liquids in the hydration reaction

  摘要：

  Sulfonic acid group functionalized imidazole based Bronsted acidic ionic liquids (BAILS) were synthesized and their activities were investigated in the hydration reaction of alkynes. The Hammett acidity order determined from UV-visible spectroscopy of BAILs is consistent with their activity order observed in hydration reactions. Theoretical studies further help to establish the structure-activity relationship. Recycling experiments suggest that these novel BAILs can be reused without significant loss in activity. Applicability of BAILs in hydration reaction opens a non-toxic, economical, and eco-friendly route to synthesize alkyl ketones from alkynes. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.04.066

文献信息

• A simple, eco-friendly, and recyclable bi-functional acidic ionic liquid catalysts for Beckmann rearrangement
  作者：Rajkumar Kore、Rajendra Srivastava

  DOI：10.1016/j.molcata.2013.04.021

  日期：2013.9

  A library of ionic liquids was prepared by varying the cations and anions. Bi-functional acidic ionic liquids were prepared by the direct combination of ionic liquids and ZnCl2. Ionic liquids were investigated in the Beckmann rearrangements. A simple, eco-friendly, and recyclable bi-functional acidic ionic liquid based protocol for Beckmann rearrangement is developed, which is based on the fine tuning of the Bronsted and the Lewis acidity of ionic liquids. (C) 2013 Elsevier B.V. All rights reserved.