| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2E33CP3MKW |
| EPA CompTox | DTXSID30214754 |
| InChI Key | JYCRKSLWSLBYLT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H26O4 |
| Molecular Weight | 258.18 |
| AlogP | 3.23 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 645-69-2 |
| NORMAN SUSDAT | |
| FDA SRS | 2E33CP3MKW |
| PubChem | 69528 |
| ChemSpider | 62732.0 |