| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NPF2MDR3G2 |
| EPA CompTox | DTXSID7064314 |
| InChI Key | QCSZITHNACKGTF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H12O4 |
| Molecular Weight | 268.07 |
| AlogP | 2.48 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6407-55-2 |
| NORMAN SUSDAT | |
| FDA SRS | NPF2MDR3G2 |
| PubChem | 80827 |
| ChemSpider | 72979.0 |