3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
Compound characteristics
| Compound ID: | K951-0113 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid |
| Molecular Weight: | 168.19 |
| Molecular Formula: | C8 H12 N2 O2 |
| Smiles: | Cc1c(CCC(O)=O)c(C)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7311 |
| logD: | -2.0956 |
| logSw: | -0.6535 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.537 |
| InChI Key: | NKTYLFMWIMKAKT-UHFFFAOYSA-N |