| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID201004748 |
| InChI Key | LTCVMBPRCIDPHB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H20O3 |
| Molecular Weight | 224.14 |
| AlogP | 2.31 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 38.83 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 84473-78-9 |
| NORMAN SUSDAT | |
| PubChem | 5743838 |