1-benzyl-5-bromo-3-nitro-1H-1,2,4-triazole
Chemical Structure Depiction of
1-benzyl-5-bromo-3-nitro-1H-1,2,4-triazole
1-benzyl-5-bromo-3-nitro-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8019-8189 |
| Compound Name: | 1-benzyl-5-bromo-3-nitro-1H-1,2,4-triazole |
| Molecular Weight: | 283.08 |
| Molecular Formula: | C9 H7 Br N4 O2 |
| Smiles: | C(c1ccccc1)n1c(nc(n1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.1137 |
| logD: | 2.1137 |
| logSw: | -2.3087 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.933 |
| InChI Key: | APQDJMZOMFOWQX-UHFFFAOYSA-N |