4-chloro-1-[(3-fluorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-chloro-1-[(3-fluorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
4-chloro-1-[(3-fluorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0431 |
| Compound Name: | 4-chloro-1-[(3-fluorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 270.64 |
| Molecular Formula: | C11 H8 Cl F N2 O3 |
| Smiles: | C(n1cc(c(C(O)=O)n1)[Cl])Oc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 1.9725 |
| logD: | -2.1366 |
| logSw: | -2.4832 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.673 |
| InChI Key: | CZYTYRTWOGKPAO-UHFFFAOYSA-N |