| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | AJ8TDS5TFC |
| EPA CompTox | DTXSID60166434 |
Structure
| InChI Key | BQBROHBMIBOPFU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14O1 |
| Molecular Weight | 150.1 |
| AlogP | 2.65 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1585-06-4 |
| NORMAN SUSDAT | |
| FDA SRS | AJ8TDS5TFC |
| PubChem | 74107 |
| ChemSpider | 66721.0 |
CONTENTS
