4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoic acid
Chemical Structure Depiction of
4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoic acid
4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoic acid
Compound characteristics
| Compound ID: | Y503-2039 |
| Compound Name: | 4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoic acid |
| Molecular Weight: | 236.65 |
| Molecular Formula: | C11 H9 Cl N2 O2 |
| Smiles: | C(c1ccc(cc1)C(O)=O)n1cc(cn1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.3075 |
| logD: | -0.664 |
| logSw: | -2.9124 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.152 |
| InChI Key: | UGZUJTGYNFLQEC-UHFFFAOYSA-N |