4-nitro-5-(2-nitrophenyl)-2H-1,2,3-triazole
Chemical Structure Depiction of
4-nitro-5-(2-nitrophenyl)-2H-1,2,3-triazole
4-nitro-5-(2-nitrophenyl)-2H-1,2,3-triazole
Compound characteristics
| Compound ID: | 8004-7509 |
| Compound Name: | 4-nitro-5-(2-nitrophenyl)-2H-1,2,3-triazole |
| Molecular Weight: | 235.16 |
| Molecular Formula: | C8 H5 N5 O4 |
| Smiles: | c1ccc(c(c1)c1c(n[nH]n1)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9788 |
| logD: | -2.777 |
| logSw: | -2.2069 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.035 |
| InChI Key: | RXKJVBIHCJIJCD-UHFFFAOYSA-N |