3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoic acid
Chemical Structure Depiction of
3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoic acid
3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoic acid
Compound characteristics
| Compound ID: | Y507-2593 |
| Compound Name: | 3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoic acid |
| Molecular Weight: | 273.08 |
| Molecular Formula: | C10 H9 Br O4 |
| Smiles: | COc1cc(/C=C/C(O)=O)cc(c1O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.0317 |
| logD: | -1.1589 |
| logSw: | -1.7694 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.732 |
| InChI Key: | NGBVBJQUJJKRGF-UHFFFAOYSA-N |