1-[(2,4-dichlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2,4-dichlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid
1-[(2,4-dichlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1222 |
| Compound Name: | 1-[(2,4-dichlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 271.1 |
| Molecular Formula: | C11 H8 Cl2 N2 O2 |
| Smiles: | C(c1ccc(cc1[Cl])[Cl])n1ccc(C(O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5888 |
| logD: | -0.3164 |
| logSw: | -2.8202 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.035 |
| InChI Key: | SBXMZCQEZYAYBD-UHFFFAOYSA-N |