2-(4-nitro-1H-pyrazol-1-yl)butanoic acid
Chemical Structure Depiction of
2-(4-nitro-1H-pyrazol-1-yl)butanoic acid
2-(4-nitro-1H-pyrazol-1-yl)butanoic acid
Compound characteristics
| Compound ID: | Y503-2379 |
| Compound Name: | 2-(4-nitro-1H-pyrazol-1-yl)butanoic acid |
| Molecular Weight: | 199.16 |
| Molecular Formula: | C7 H9 N3 O4 |
| Smiles: | CCC(C(O)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2153 |
| logD: | -3.2425 |
| logSw: | -0.547 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.194 |
| InChI Key: | WCWIOBFYLVTFFO-LURJTMIESA-N |