| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | C3B9R0E116 |
| EPA CompTox | DTXSID30883444 |
| InChI Key | DXGZIMYAPNIRHS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H26O3 |
| Molecular Weight | 242.19 |
| AlogP | 3.03 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 579-94-2 |
| NORMAN SUSDAT | |
| FDA SRS | C3B9R0E116 |
| PubChem | 10444425 |