| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID40967244 |
Structure
| InChI Key | ARDBEZFTUVBDOJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H6O2 |
| Molecular Weight | 86.04 |
| AlogP | -0.03 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 29.6 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 52788-68-8 |
| NORMAN SUSDAT | |
| PubChem | 103687 |
CONTENTS
