3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoic acid
Chemical Structure Depiction of
3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoic acid
3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoic acid
Compound characteristics
| Compound ID: | Y507-2910 |
| Compound Name: | 3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoic acid |
| Molecular Weight: | 329.14 |
| Molecular Formula: | C13 H13 Br O5 |
| Smiles: | CCOC(COc1ccc(cc1/C=C/C(O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9647 |
| logD: | 0.1709 |
| logSw: | -2.9216 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.367 |
| InChI Key: | XTGVULDSOWPACF-UHFFFAOYSA-N |