3-(3-chlorophenyl)-1-methyl-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
3-(3-chlorophenyl)-1-methyl-1H-pyrazole-5-carboxylic acid
3-(3-chlorophenyl)-1-methyl-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y042-3095 |
| Compound Name: | 3-(3-chlorophenyl)-1-methyl-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 236.65 |
| Molecular Formula: | C11 H9 Cl N2 O2 |
| Smiles: | Cn1c(cc(c2cccc(c2)[Cl])n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2319 |
| logD: | -3.001 |
| logSw: | -2.7723 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.891 |
| InChI Key: | FNZUGHJDLQTKKA-UHFFFAOYSA-N |