5,5'-dinitro-2H,2'H-3,3'-bi-1,2,4-triazole
Chemical Structure Depiction of
5,5'-dinitro-2H,2'H-3,3'-bi-1,2,4-triazole
5,5'-dinitro-2H,2'H-3,3'-bi-1,2,4-triazole
Compound characteristics
| Compound ID: | 8005-3419 |
| Compound Name: | 5,5'-dinitro-2H,2'H-3,3'-bi-1,2,4-triazole |
| Molecular Weight: | 226.11 |
| Molecular Formula: | C4 H2 N8 O4 |
| Smiles: | c1(nc(c2nc(n[nH]2)[N+]([O-])=O)[nH]n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.0301 |
| logD: | -5.0061 |
| logSw: | -0.5979 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.697 |
| InChI Key: | AHXZYSSGVZAEPX-UHFFFAOYSA-N |