| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 87T3RQM2CS |
| EPA CompTox | DTXSID90228635 |
Structure
| InChI Key | QZMQKPGVXNSITP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6O3 |
| Molecular Weight | 150.03 |
| AlogP | 1.23 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 7797-83-3 |
| NORMAN SUSDAT | |
| FDA SRS | 87T3RQM2CS |
| PubChem | 82264 |
| ChemSpider | 74240.0 |
CONTENTS
