3-[(4-methylphenyl)methanesulfonyl]propanoic acid
Chemical Structure Depiction of
3-[(4-methylphenyl)methanesulfonyl]propanoic acid
3-[(4-methylphenyl)methanesulfonyl]propanoic acid
Compound characteristics
| Compound ID: | K783-4927 |
| Compound Name: | 3-[(4-methylphenyl)methanesulfonyl]propanoic acid |
| Molecular Weight: | 242.29 |
| Molecular Formula: | C11 H14 O4 S |
| Smiles: | Cc1ccc(CS(CCC(O)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 0.5068 |
| logD: | -3.3585 |
| logSw: | -1.7738 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.923 |
| InChI Key: | WXIZKTAKGPSNNP-UHFFFAOYSA-N |