4-chloro-1-[(4-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-chloro-1-[(4-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxylic acid
4-chloro-1-[(4-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0961 |
| Compound Name: | 4-chloro-1-[(4-methoxyphenoxy)methyl]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 282.68 |
| Molecular Formula: | C12 H11 Cl N2 O4 |
| Smiles: | COc1ccc(cc1)OCn1cc(c(C(O)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.8459 |
| logD: | -2.2632 |
| logSw: | -2.3895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.217 |
| InChI Key: | LLIKKKKTVGAVDP-UHFFFAOYSA-N |