3-[4-(benzyloxy)-2-chloro-5-methoxyphenyl]prop-2-enoic acid
Chemical Structure Depiction of
3-[4-(benzyloxy)-2-chloro-5-methoxyphenyl]prop-2-enoic acid
3-[4-(benzyloxy)-2-chloro-5-methoxyphenyl]prop-2-enoic acid
Compound characteristics
| Compound ID: | Y507-3288 |
| Compound Name: | 3-[4-(benzyloxy)-2-chloro-5-methoxyphenyl]prop-2-enoic acid |
| Molecular Weight: | 318.75 |
| Molecular Formula: | C17 H15 Cl O4 |
| Smiles: | COc1cc(/C=C/C(O)=O)c(cc1OCc1ccccc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5932 |
| logD: | 0.5453 |
| logSw: | -3.4116 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.567 |
| InChI Key: | NKRGLDPYVZYDBE-UHFFFAOYSA-N |