3-(benzylsulfanyl)propanoic acid
Chemical Structure Depiction of
3-(benzylsulfanyl)propanoic acid
3-(benzylsulfanyl)propanoic acid
Compound characteristics
| Compound ID: | Y030-1726 |
| Compound Name: | 3-(benzylsulfanyl)propanoic acid |
| Molecular Weight: | 196.26 |
| Molecular Formula: | C10 H12 O2 S |
| Smiles: | C(CSCc1ccccc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7941 |
| logD: | -1.7706 |
| logSw: | -1.7785 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.6222 |
| InChI Key: | NDBNSZKHDMXOJE-UHFFFAOYSA-N |