| 1313405-64-9

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酰胺类
• CAS: 1313405-64-9
• 化学式: C₈₀H₁₁₂N₈O₁₆
• 分子量: 1441.81
• InChiKey: JMEGQLCFDXBWCF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.19
• 重原子数：
  104.0
• 可旋转键数：
  32.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  322.32
• 氢给体数：
  8.0
• 氢受体数：
  16.0

反应信息

• 作为产物：
  描述：

  allyl (2-(octyloxy)-5-(2-(2-(octyloxy)-5-(pent-4-enamido)benzamido)acetamido)benzoyl)glycinate 在 Grubbs catalyst first generation 作用下， 以 二氯甲烷 为溶剂， 生成 、
  参考文献：
  名称：

  Interplay of Olefin Metathesis and Multiple Hydrogen Bonding Interactions: Covalently Cross-linked Zippers

  摘要：

  Hydrogen-bonded zippers bearing terminal alkene groups were treated with Grubbs' catalyst, leading to covalently cross-linked zippers without violating H-bonding sequence specificity. The yield of a cross-linked zipper depended on the stability of its H-bonded precursor, with a weakly associating pair giving reasonable yields only at high concentrations while strongly associating pairs showed nearly quantitative yields. The Integration of thermodynamic (H-bonding) and kinetic (irreversible C=C bond formation) processes suggests the possibility of developing many different covalent association units for constructing molecular structures based on a self-assembling way.

  DOI：

  10.1021/ol201282d