methyl 1-[(3-chlorophenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 1-[(3-chlorophenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
methyl 1-[(3-chlorophenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | Y507-3920 |
| Compound Name: | methyl 1-[(3-chlorophenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 318.68 |
| Molecular Formula: | C13 H10 Cl F3 N2 O2 |
| Smiles: | COC(c1cn(Cc2cccc(c2)[Cl])nc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3201 |
| logD: | 3.3201 |
| logSw: | -3.633 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.464 |
| InChI Key: | AYBDDOFNEFRVQU-UHFFFAOYSA-N |