1-[(3-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-[(3-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid
1-[(3-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0429 |
| Compound Name: | 1-[(3-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 216.24 |
| Molecular Formula: | C12 H12 N2 O2 |
| Smiles: | Cc1cccc(Cn2cc(cn2)C(O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.3104 |
| logD: | -0.5394 |
| logSw: | -2.1967 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.152 |
| InChI Key: | PBGWCCZEAHKYKB-UHFFFAOYSA-N |