1-[(2-chlorophenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-chlorophenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid
1-[(2-chlorophenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1334 |
| Compound Name: | 1-[(2-chlorophenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 304.65 |
| Molecular Formula: | C12 H8 Cl F3 N2 O2 |
| Smiles: | C(c1ccccc1[Cl])n1c(cc(C(O)=O)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.8594 |
| logD: | 0.646 |
| logSw: | -3.0943 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.605 |
| InChI Key: | KHYJGTUDHYJFEK-UHFFFAOYSA-N |