| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A9WY6Q0U9C |
| EPA CompTox | DTXSID4062016 |
Structure
| InChI Key | ZHHZHHSFKCANOC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H6O2 |
| Molecular Weight | 86.04 |
| AlogP | 0.35 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1838-59-1 |
| NORMAN SUSDAT | |
| FDA SRS | A9WY6Q0U9C |
| PubChem | 61278 |
CONTENTS
