1-[(2-chlorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-chlorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
1-[(2-chlorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y502-0765 |
| Compound Name: | 1-[(2-chlorophenoxy)methyl]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 252.65 |
| Molecular Formula: | C11 H9 Cl N2 O3 |
| Smiles: | C(n1ccc(C(O)=O)n1)Oc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.8033 |
| logD: | -1.3883 |
| logSw: | -2.189 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.097 |
| InChI Key: | SIBGVAKNBXLWQM-UHFFFAOYSA-N |