methyl 1-[(2-chloro-4-fluorophenyl)methyl]-3-(difluoromethyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 1-[(2-chloro-4-fluorophenyl)methyl]-3-(difluoromethyl)-1H-pyrazole-4-carboxylate
methyl 1-[(2-chloro-4-fluorophenyl)methyl]-3-(difluoromethyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | Y507-3898 |
| Compound Name: | methyl 1-[(2-chloro-4-fluorophenyl)methyl]-3-(difluoromethyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 318.68 |
| Molecular Formula: | C13 H10 Cl F3 N2 O2 |
| Smiles: | COC(c1cn(Cc2ccc(cc2[Cl])F)nc1C(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.304 |
| logD: | 3.304 |
| logSw: | -3.5492 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.464 |
| InChI Key: | AXCSDNXOWSCZKN-UHFFFAOYSA-N |