| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R8RC3Q7T1W |
| EPA CompTox | DTXSID40239150 |
Structure
| InChI Key | KMTUBAIXCBHPIZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12S2 |
| Molecular Weight | 136.04 |
| AlogP | 2.02 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 928-98-3 |
| NORMAN SUSDAT | |
| FDA SRS | R8RC3Q7T1W |
| PubChem | 70236 |
| ChemSpider | 63421.0 |
CONTENTS
