| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 529XY6M4QX |
| EPA CompTox | DTXSID00862827 |
Structure
| InChI Key | QUSTYFNPKBDELJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12S |
| Molecular Weight | 104.07 |
| AlogP | 2.1 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2084-19-7 |
| NORMAN SUSDAT | |
| FDA SRS | 529XY6M4QX |
| PubChem | 62424 |
CONTENTS
