| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 75B0PMW2JF |
| EPA CompTox | DTXSID60223339 |
Structure
| InChI Key | JPIJQSOTBSSVTP-STHAYSLISA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H8O5 |
| Molecular Weight | 136.04 |
| AlogP | -2.21 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 97.99 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 7306-96-9 |
| NORMAN SUSDAT | |
| FDA SRS | 75B0PMW2JF |
| PubChem | 5460407 |
| ChemSpider | 388628.0 |
CONTENTS
