| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 0X7Y34707N |
| EPA CompTox | DTXSID6063353 |
Structure
| InChI Key | SJRQTHAMRUOPBJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8O3 |
| Molecular Weight | 152.05 |
| AlogP | 1.62 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 39.44 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4208-49-5 |
| NORMAN SUSDAT | |
| FDA SRS | 0X7Y34707N |
| PubChem | 61337 |
| ChemSpider | 55273.0 |
CONTENTS
