sodium 3-<<1,2-bis<<(2-ethylhexyl)oxy>carbonyl>ethyl>thio>succinate | 135513-30-3

• 分子结构分类: 有机化合物
• 英文名称: sodium 3-<<1,2-bis<<(2-ethylhexyl)oxy>carbonyl>ethyl>thio>succinate
• 英文别名: sodium 3-({1,2-bis[[(2-ethylhexyl)oxy]carbonyl]ethyl}thio)succinate
• CAS: 135513-30-3
• 化学式: C₂₄H₄₁O₈S*Na
• 分子量: 512.641
• InChiKey: CLKCONHJDBXMPO-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  0.59
• 重原子数：
  34.0
• 可旋转键数：
  20.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  130.03
• 氢给体数：
  1.0
• 氢受体数：
  8.0

反应信息

• 作为产物：
  描述：

  巯基丁二酸 、 bis(2-ethylhexyl) maleate 在 sodium hydroxide 作用下， 以 水 、 N,N-二甲基甲酰胺 为溶剂， 以50%的产率得到sodium 3-<<1,2-bis<<(2-ethylhexyl)oxy>carbonyl>ethyl>thio>succinate
  参考文献：
  名称：

  Reverse micelles as a model system for carbohydrate binding

  摘要：

  The surfactant sodium 3-[[1,2-bis[[(2-ethylhexyl)oxy]carbonyl]ethyl]thio]succinate (1) aggregates in chloroform/cyclohexane (1:1, v/v) mixture to form inverse micelles. The small-angle X-ray scattering from these solutions indicates that the aggregates are approximately spherical with a radius of gyration that varies from 6.3 to 18.5 angstrom, depending upon the amount of added water. These inverse micelles can bind and solubilize monosaccharides in nonpolar organic solvents. H-1 and C-13 NMR, as well as ESR experiments on these solutions, indicate that monosaccharide derivatives are bound to the surfactant head group at low water content and are solubilized in the water pool at high water content.

  DOI：

  10.1021/ja00019a021