| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 94IEA0NV89 |
| EPA CompTox | DTXSID9021267 |
Structure
| InChI Key | LUSZGTFNYDARNI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6O3 |
| Molecular Weight | 138.03 |
| AlogP | 1.12 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 38.69 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 533-31-3 |
| NORMAN SUSDAT | |
| FDA SRS | 94IEA0NV89 |
| PubChem | 68289 |
| ChemSpider | 61586.0 |
CONTENTS
