Tert-butyl 8-(2,2-dimethylbutanoyloxy)-5-oxo-4-oxatricyclo[4.3.1.13,8]undecane-1-carboxylate;8-(2,2-dimethylbutanoyloxy)-5-oxo-4-oxatricyclo[4.3.1.13,8]undecane-1-carboxylic acid;(6,8-dimethyl-5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl) 2,2-dimethylbutanoate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Tert-butyl 8-(2,2-dimethylbutanoyloxy)-5-oxo-4-oxatricyclo[4.3.1.13,8]undecane-1-carboxylate;8-(2,2-dimethylbutanoyloxy)-5-oxo-4-oxatricyclo[4.3.1.13,8]undecane-1-carboxylic acid;(6,8-dimethyl-5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl) 2,2-dimethylbutanoate
• 英文别名: tert-butyl 8-(2,2-dimethylbutanoyloxy)-5-oxo-4-oxatricyclo[4.3.1.13,8]undecane-1-carboxylate;8-(2,2-dimethylbutanoyloxy)-5-oxo-4-oxatricyclo[4.3.1.13,8]undecane-1-carboxylic acid;(6,8-dimethyl-5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl) 2,2-dimethylbutanoate
• 化学式: C56H84O16
• 分子量: 1013.3
• InChiKey: ITXPNPAXEFEJQP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.47
• 重原子数：
  72
• 可旋转键数：
  16
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  221
• 氢给体数：
  1
• 氢受体数：
  16