3-(3,4-dimethoxyphenyl)-2-sulfanylprop-2-enoic acid
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-2-sulfanylprop-2-enoic acid
3-(3,4-dimethoxyphenyl)-2-sulfanylprop-2-enoic acid
Compound characteristics
| Compound ID: | 1683-0112 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-2-sulfanylprop-2-enoic acid |
| Molecular Weight: | 240.27 |
| Molecular Formula: | C11 H12 O4 S |
| Smiles: | COc1ccc(/C=C(/C(O)=O)S)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.4481 |
| logD: | -3.1339 |
| logSw: | -1.8077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.907 |
| InChI Key: | CBSSDYIFWLVFGD-UHFFFAOYSA-N |