| 1376295-12-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• CAS: 1376295-12-3
• 化学式: Br*C₂₅H₄₅N₂*C₄₈H₄₈N₃₂O₁₆
• 分子量: 1782.66
• InChiKey: FLTHMEJEJZJOTR-IIKCYMFNSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -3.16
• 重原子数：
  124.0
• 可旋转键数：
  20.0
• 环数：
  25.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  385.61
• 氢给体数：
  0.0
• 氢受体数：
  17.0

反应信息

• 作为产物：
  描述：

  1,3-di(undec-10-en-1-yl)-1H-imidazol-3-ium bromide 、 cucurbit[8]uril 在 potassium chloride 作用下， 以 水 为溶剂， 生成
  参考文献：
  名称：

  Influence of self-assembly of amphiphilic imidazolium ionic liquids on their host–guest complexes with cucurbit[n]urils

  摘要：

  Two symmetric amphiphilic imidazolium ionic liquids having omega-undecenyl chains form supramolecular complexes with CB[7] and CB[8] in water as revealed by H-1 NMR spectroscopy and MALDI-MS. Binding constants in the range 10(4) to 10(5) M-1 were estimated from the conductivity measurements for the 1:1 complexes of these imidazolium ionic liquids with CB[7] and CB[8]. Radical initiated polymerization of these host-guest complexes at concentrations above the critical self-assembly concentration of imidazolium ionic liquids to form liposomes, destroys completely (CB[7]) or partially (CB[8]) the host-guest ionic liquid@CB[n] complex; this behaviour was proved by titration with acridine orange tricyclic dye, of CB[n]s in the colloidal solutions of the liposomes before and after performing dialysis to remove free CB [n]s. Thus, the increase in the fluorescence emission of acridine orange by CB[7] is not observed if the polymerized ionic liquid@CB[7] complex is submitted to dialysis to remove uncomplexed CB[7]. Analogous study by titration of absorbance change of acridine orange solutions caused by CB[8], reveals only a partial destruction of the host-guest complex by self-assembly of amphiphilic ionic liquid above the critical self-assembly concentration. The results obtained have been rationalized considering that the driving force for the formation of supramolecular ionic liquid@CB[n] complexes is a hydrophobic interaction between the apolar alkenyl chain and the cucurbituril interior cavity and that these hydrophobic interactions are disturbed when self-assembly leading to liposomes occurs. (c) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.03.044