| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BLA42VBH65 |
| EPA CompTox | DTXSID30169795 |
Structure
| InChI Key | FSMYWBQIMDSGQP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H6O3 |
| Molecular Weight | 174.03 |
| AlogP | 1.61 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 47.28 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 17422-74-1 |
| NORMAN SUSDAT | |
| FDA SRS | BLA42VBH65 |
| PubChem | 87112 |
| ChemSpider | 78579.0 |
CONTENTS
