| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 98MGL3QL2K |
| EPA CompTox | DTXSID20189760 |
Structure
| InChI Key | NBKFKDJHUNQQKY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H10O3 |
| Molecular Weight | 190.06 |
| AlogP | 1.98 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 36195-33-2 |
| NORMAN SUSDAT | |
| FDA SRS | 98MGL3QL2K |
| PubChem | 118924 |
| ChemSpider | 106268.0 |
CONTENTS
