| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID4070744 |
| InChI Key | QHMTZLHLQBIYJA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.09 |
| AlogP | 1.68 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 27.69 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 67874-68-4 |
| NORMAN SUSDAT | |
| PubChem | 105897 |
| ChemSpider | 95429.0 |