| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | YA2V724S0A |
| EPA CompTox | DTXSID7044425 |
Structure
| InChI Key | JDRMYOQETPMYQX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H8O4 |
| Molecular Weight | 132.04 |
| AlogP | 0.02 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 63.6 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3878-55-5 |
| NORMAN SUSDAT | |
| FDA SRS | YA2V724S0A |
| PubChem | 77487 |
| ChemSpider | 69896.0 |
CONTENTS
