1,3-Dicyclohexyl-2-(2-imidazol-1-yl-ethyl)-isourea | 374564-86-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1,3-Dicyclohexyl-2-(2-imidazol-1-yl-ethyl)-isourea
• 英文别名: 2-imidazol-1-ylethyl N,N'-dicyclohexylcarbamimidate
• CAS: 374564-86-0
• 化学式: C₁₈H₃₀N₄O
• 分子量: 318.462
• InChiKey: PMYBJBSNEWCGKJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  23
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  51.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1,3-Dicyclohexyl-2-(2-imidazol-1-yl-ethyl)-isourea 以 乙腈 为溶剂， 反应 92.0h， 生成 3-Butyl-1-{2-[4-(2-formyl-phenoxy)-butyryloxy]-ethyl}-3H-imidazol-1-ium; iodide
  参考文献：
  名称：

  Grafted ionic liquid-phase-supported synthesis of small organic molecules

  摘要：

  The preparation and applications in the Knoevenagel and 13-dipolar cycloaddition reactions of new grafted soluble liquid phases derived from imidazolium ionic liquids are described. Good yields and high regioselectivity are the features observed with these unconventional liquid phases. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(01)01190-x
• 作为产物：
  描述：

  1-(2-羟乙基)咪唑 、 N,N'-二环己基碳二亚胺 在 copper(l) chloride 作用下， 反应 24.0h， 以63%的产率得到1,3-Dicyclohexyl-2-(2-imidazol-1-yl-ethyl)-isourea
  参考文献：
  名称：

  Grafted ionic liquid-phase-supported synthesis of small organic molecules

  摘要：

  The preparation and applications in the Knoevenagel and 13-dipolar cycloaddition reactions of new grafted soluble liquid phases derived from imidazolium ionic liquids are described. Good yields and high regioselectivity are the features observed with these unconventional liquid phases. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(01)01190-x

文献信息

• Grafted ionic liquid-phase-supported synthesis of small organic molecules
  作者：Joan Fraga-Dubreuil、Jean Pierre Bazureau

  DOI：10.1016/s0040-4039(01)01190-x

  日期：2001.8

  The preparation and applications in the Knoevenagel and 13-dipolar cycloaddition reactions of new grafted soluble liquid phases derived from imidazolium ionic liquids are described. Good yields and high regioselectivity are the features observed with these unconventional liquid phases. (C) 2001 Elsevier Science Ltd. All rights reserved.