| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | S9IX5I5C0K |
| EPA CompTox | DTXSID00197161 |
Structure
| InChI Key | RQNVIKXOOKXAJQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H6O4 |
| Molecular Weight | 190.03 |
| AlogP | 1.03 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 74.6 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 475-38-7 |
| NORMAN SUSDAT | |
| FDA SRS | S9IX5I5C0K |
| PubChem | 10141 |
| ChemSpider | 9735.0 |
CONTENTS
