3-[2-bromo-5-methoxy-4-(2-phenylethoxy)phenyl]prop-2-enoic acid
Chemical Structure Depiction of
3-[2-bromo-5-methoxy-4-(2-phenylethoxy)phenyl]prop-2-enoic acid
3-[2-bromo-5-methoxy-4-(2-phenylethoxy)phenyl]prop-2-enoic acid
Compound characteristics
| Compound ID: | Y508-5205 |
| Compound Name: | 3-[2-bromo-5-methoxy-4-(2-phenylethoxy)phenyl]prop-2-enoic acid |
| Molecular Weight: | 377.23 |
| Molecular Formula: | C18 H17 Br O4 |
| Smiles: | COc1cc(/C=C/C(O)=O)c(cc1OCCc1ccccc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.068 |
| logD: | 1.0505 |
| logSw: | -4.1993 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.486 |
| InChI Key: | FBRHBMGGYRNXJV-UHFFFAOYSA-N |