3-(3,4-dimethoxybenzene-1-sulfonyl)propanoic acid
Chemical Structure Depiction of
3-(3,4-dimethoxybenzene-1-sulfonyl)propanoic acid
3-(3,4-dimethoxybenzene-1-sulfonyl)propanoic acid
Compound characteristics
| Compound ID: | Y043-8214 |
| Compound Name: | 3-(3,4-dimethoxybenzene-1-sulfonyl)propanoic acid |
| Molecular Weight: | 274.29 |
| Molecular Formula: | C11 H14 O6 S |
| Smiles: | COc1ccc(cc1OC)S(CCC(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0341 |
| logD: | -3.5583 |
| logSw: | -1.8501 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.919 |
| InChI Key: | KRBIPGZIRGLRBB-UHFFFAOYSA-N |