Tert-butyl 5-(cyclohexylperoxysulfanylcarbamoyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;9,10-dimethyl-5-[1-(2-methylpropoxy)ethoxycarbonyl]tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;5-(1-ethoxyethoxycarbonyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;5-(ethoxymethoxycarbonyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: Tert-butyl 5-(cyclohexylperoxysulfanylcarbamoyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;9,10-dimethyl-5-[1-(2-methylpropoxy)ethoxycarbonyl]tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;5-(1-ethoxyethoxycarbonyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;5-(ethoxymethoxycarbonyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid
• 英文别名: tert-butyl 5-(cyclohexylperoxysulfanylcarbamoyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;9,10-dimethyl-5-[1-(2-methylpropoxy)ethoxycarbonyl]tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;5-(1-ethoxyethoxycarbonyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;5-(ethoxymethoxycarbonyl)-9,10-dimethyltetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid
• 化学式: C87H133NO20S
• 分子量: 1545.0
• InChiKey: ORVLGCXXZDTACK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.67
• 重原子数：
  109
• 可旋转键数：
  27
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  318
• 氢给体数：
  4
• 氢受体数：
  21