| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | APY3P7S1XM |
| EPA CompTox | DTXSID7062166 |
Structure
| InChI Key | GEKDEMKPCKTKEC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H30S1 |
| Molecular Weight | 230.21 |
| AlogP | 5.62 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 12.0 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2079-95-0 |
| NORMAN SUSDAT | |
| FDA SRS | APY3P7S1XM |
| PubChem | 64677 |
| ChemSpider | 58226.0 |
CONTENTS
