3-(3-nitro-1H-pyrazol-1-yl)butanoic acid
Chemical Structure Depiction of
3-(3-nitro-1H-pyrazol-1-yl)butanoic acid
3-(3-nitro-1H-pyrazol-1-yl)butanoic acid
Compound characteristics
| Compound ID: | Y507-1193 |
| Compound Name: | 3-(3-nitro-1H-pyrazol-1-yl)butanoic acid |
| Molecular Weight: | 199.16 |
| Molecular Formula: | C7 H9 N3 O4 |
| Smiles: | CC(CC(O)=O)n1ccc(n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.5322 |
| logD: | -3.3217 |
| logSw: | -1.1805 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.896 |
| InChI Key: | DBIBFHYAZBGGKL-YFKPBYRVSA-N |