| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50174583 |
Structure
| InChI Key | OMHOEQINEXASKE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8O4 |
| Molecular Weight | 144.04 |
| AlogP | -0.29 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 60.44 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 20577-61-1 |
| NORMAN SUSDAT | |
| PubChem | 88600 |
| ChemSpider | 79938.0 |
CONTENTS
