| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R5TCC7VX7J |
| EPA CompTox | DTXSID60205771 |
| InChI Key | XMXCRJLWEKHZAV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H6O2 |
| Molecular Weight | 146.04 |
| AlogP | 1.4 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 57134-53-9 |
| NORMAN SUSDAT | |
| FDA SRS | R5TCC7VX7J |
| PubChem | 92680 |
| ChemSpider | 83663.0 |