| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10194666 |
| InChI Key | MWVYOMQTCFCPHY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H26O1S1 |
| Molecular Weight | 218.17 |
| AlogP | 3.85 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 41891-88-7 |
| NORMAN SUSDAT | |
| PubChem | 96654 |
| ChemSpider | 87262.0 |