| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50232894 |
| InChI Key | CUZYKBDJOKMPFH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H16O3 |
| Molecular Weight | 148.11 |
| AlogP | 0.77 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 38.69 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 84000-92-0 |
| NORMAN SUSDAT | |
| PubChem | 3019577 |
| ChemSpider | 2286720.0 |