HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-(4-Methoxy-phenylsulfanyl)pentanoic acid ethyl ester
Identifiers & Physical Properties
| Molecular formula | C14H20O3S |
|---|---|
| Average molar mass | 268.37 g/mol |
| SMILES | CCCC(Sc1ccc(OC)cc1)C(=O)OCC |
| InChIKey | ZXEMOHZODGJZRR-UHFFFAOYSA-N |
| PubChem CID | 54570902 |
Chemical & Physical Properties
| XLogP | 4 |
|---|---|
| Topological polar surface area | 60.8 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 8 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 237 |