4,6-Dimethyl-8,10-dinitro-2,12-dioxa-4,6,8,10-tetrazatetracyclo[5.5.0.03,11.05,9]dodecane;4,6-dimethyl-10,12-dinitro-2,8-dioxa-4,6,10,12-tetrazatetracyclo[5.5.0.03,11.05,9]dodecane;4-methyl-10,12-dinitro-2,6,8-trioxa-4,10,12-triazatetracyclo[5.5.0.03,11.05,9]dodecane;4-methyl-10-nitro-2,6,8,12-tetraoxa-4,10-diazatetracyclo[5.5.0.03,11.05,9]dodecane;8,10,12-trimethyl-4,6-dinitro-2-oxa-4,6,8,10,12-pentazatetracyclo[5.5.0.03,11.05,9]dodecane

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 4,6-Dimethyl-8,10-dinitro-2,12-dioxa-4,6,8,10-tetrazatetracyclo[5.5.0.03,11.05,9]dodecane;4,6-dimethyl-10,12-dinitro-2,8-dioxa-4,6,10,12-tetrazatetracyclo[5.5.0.03,11.05,9]dodecane;4-methyl-10,12-dinitro-2,6,8-trioxa-4,10,12-triazatetracyclo[5.5.0.03,11.05,9]dodecane;4-methyl-10-nitro-2,6,8,12-tetraoxa-4,10-diazatetracyclo[5.5.0.03,11.05,9]dodecane;8,10,12-trimethyl-4,6-dinitro-2-oxa-4,6,8,10,12-pentazatetracyclo[5.5.0.03,11.05,9]dodecane
• 英文别名: 4,6-dimethyl-8,10-dinitro-2,12-dioxa-4,6,8,10-tetrazatetracyclo[5.5.0.03,11.05,9]dodecane;4,6-dimethyl-10,12-dinitro-2,8-dioxa-4,6,10,12-tetrazatetracyclo[5.5.0.03,11.05,9]dodecane;4-methyl-10,12-dinitro-2,6,8-trioxa-4,10,12-triazatetracyclo[5.5.0.03,11.05,9]dodecane;4-methyl-10-nitro-2,6,8,12-tetraoxa-4,10-diazatetracyclo[5.5.0.03,11.05,9]dodecane;8,10,12-trimethyl-4,6-dinitro-2-oxa-4,6,8,10,12-pentazatetracyclo[5.5.0.03,11.05,9]dodecane
• 化学式: C39H57N27O30
• 分子量: 1384.0
• InChiKey: CIJKSJHRMADUFI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -9.98
• 重原子数：
  96
• 可旋转键数：
  0
• 环数：
  21.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  582
• 氢给体数：
  0
• 氢受体数：
  48