| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | S477T6X6YA |
| EPA CompTox | DTXSID10240733 |
| InChI Key | CUYLNCWYFSSEQG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H16O1 |
| Molecular Weight | 164.12 |
| AlogP | 3.04 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 94134-86-8 |
| NORMAN SUSDAT | |
| FDA SRS | S477T6X6YA |
| PubChem | 100504 |
| ChemSpider | 90805.0 |