| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20177501 |
| InChI Key | VYLTWLWJTAJDSS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H12O5 |
| Molecular Weight | 224.07 |
| AlogP | 1.27 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 61.83 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 22955-73-3 |
| NORMAN SUSDAT | |
| PubChem | 89938 |
| ChemSpider | 81186.0 |