3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid
3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid
Compound characteristics
| Compound ID: | D012-0068 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoic acid |
| Molecular Weight: | 168.19 |
| Molecular Formula: | C8 H12 N2 O2 |
| Smiles: | Cc1cc(C)n(CCC(O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.6409 |
| logD: | -3.4612 |
| logSw: | -0.4317 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.608 |
| InChI Key: | PKTDVEIIOHCFMB-UHFFFAOYSA-N |