3-(phenylmethanesulfonyl)propanoic acid
Chemical Structure Depiction of
3-(phenylmethanesulfonyl)propanoic acid
3-(phenylmethanesulfonyl)propanoic acid
Compound characteristics
| Compound ID: | Y030-1727 |
| Compound Name: | 3-(phenylmethanesulfonyl)propanoic acid |
| Molecular Weight: | 228.26 |
| Molecular Formula: | C10 H12 O4 S |
| Smiles: | C(CS(Cc1ccccc1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0835 |
| logD: | -3.7819 |
| logSw: | -1.5958 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.923 |
| InChI Key: | DXVJEQSCVWZYQP-UHFFFAOYSA-N |