4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid
4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y501-6246 |
| Compound Name: | 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 235.98 |
| Molecular Formula: | C4 H2 Br N3 O4 |
| Smiles: | C(c1c(c(n[nH]1)[N+]([O-])=O)[Br])(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3764 |
| logD: | -5.1 |
| logSw: | -0.7323 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.493 |
| InChI Key: | AYVPVIOGABUWIE-UHFFFAOYSA-N |