methyl 3-{[(3-methylphenyl)methyl]sulfanyl}propanoate
Chemical Structure Depiction of
methyl 3-{[(3-methylphenyl)methyl]sulfanyl}propanoate
methyl 3-{[(3-methylphenyl)methyl]sulfanyl}propanoate
Compound characteristics
| Compound ID: | Y203-3901 |
| Compound Name: | methyl 3-{[(3-methylphenyl)methyl]sulfanyl}propanoate |
| Molecular Weight: | 224.32 |
| Molecular Formula: | C12 H16 O2 S |
| Smiles: | Cc1cccc(CSCCC(=O)OC)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.328 |
| logD: | 3.328 |
| logSw: | -3.4433 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.8173 |
| InChI Key: | OOIIGWMOPXZILJ-UHFFFAOYSA-N |