3-(3,5-dinitrophenyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(3,5-dinitrophenyl)-1H-1,2,4-triazol-5-amine
3-(3,5-dinitrophenyl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | 8005-8781 |
| Compound Name: | 3-(3,5-dinitrophenyl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 250.17 |
| Molecular Formula: | C8 H6 N6 O4 |
| Smiles: | c1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)c1nc(N)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0705 |
| logD: | 1.0636 |
| logSw: | -1.8337 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 121.253 |
| InChI Key: | MDEWLNJXGGKYKH-UHFFFAOYSA-N |