3-nitro-1-[(4-nitrophenyl)methyl]-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Chemical Structure Depiction of
3-nitro-1-[(4-nitrophenyl)methyl]-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
3-nitro-1-[(4-nitrophenyl)methyl]-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Compound characteristics
Compound ID: | 8017-2420 |
Compound Name: | 3-nitro-1-[(4-nitrophenyl)methyl]-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole |
Molecular Weight: | 289.21 |
Molecular Formula: | C10 H7 N7 O4 |
Smiles: | C(c1ccc(cc1)[N+]([O-])=O)n1c2ncnn2c(n1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 0.7114 |
logD: | 0.7114 |
logSw: | -1.6625 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 103.932 |
InChI Key: | MIVCJSMRQLWNSI-UHFFFAOYSA-N |