Tert-butyl 5-methyl-6-[3,3,3-trifluoro-2-[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonyl-2-methylpropyl]-2-(trifluoromethyl)bicyclo[2.2.1]heptane-2-carboxylate;[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 4-[1-adamantyl(hydroperoxy)methyl]-2-methyl-2,4-bis(trifluoromethyl)hexanoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: Tert-butyl 5-methyl-6-[3,3,3-trifluoro-2-[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonyl-2-methylpropyl]-2-(trifluoromethyl)bicyclo[2.2.1]heptane-2-carboxylate;[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 4-[1-adamantyl(hydroperoxy)methyl]-2-methyl-2,4-bis(trifluoromethyl)hexanoate
• 英文别名: tert-butyl 5-methyl-6-[3,3,3-trifluoro-2-[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonyl-2-methylpropyl]-2-(trifluoromethyl)bicyclo[2.2.1]heptane-2-carboxylate;[1,1,1,3,3,3-hexafluoro-2-[4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 4-[1-adamantyl(hydroperoxy)methyl]-2-methyl-2,4-bis(trifluoromethyl)hexanoate
• 化学式: C64H76F36O9
• 分子量: 1673.2
• InChiKey: OSJGGQOIXCILDI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  22.52
• 重原子数：
  109
• 可旋转键数：
  21
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.95
• 拓扑面积：
  129
• 氢给体数：
  2
• 氢受体数：
  45