3-(3-methyl-4-nitro-1H-pyrazol-1-yl)butanoic acid
Chemical Structure Depiction of
3-(3-methyl-4-nitro-1H-pyrazol-1-yl)butanoic acid
3-(3-methyl-4-nitro-1H-pyrazol-1-yl)butanoic acid
Compound characteristics
| Compound ID: | Y507-1220 |
| Compound Name: | 3-(3-methyl-4-nitro-1H-pyrazol-1-yl)butanoic acid |
| Molecular Weight: | 213.19 |
| Molecular Formula: | C8 H11 N3 O4 |
| Smiles: | CC(CC(O)=O)n1cc(c(C)n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1979 |
| logD: | -2.9874 |
| logSw: | -0.5248 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.602 |
| InChI Key: | UWGGOYWJJHIHAI-YFKPBYRVSA-N |