| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 682PCN62W8 |
| EPA CompTox | DTXSID50179073 |
Structure
| InChI Key | DYOZNCVZPFIXLU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12O3 |
| Molecular Weight | 120.08 |
| AlogP | 0.25 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 27.69 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 24332-20-5 |
| NORMAN SUSDAT | |
| FDA SRS | 682PCN62W8 |
| PubChem | 47520 |
| ChemSpider | 43233.0 |
CONTENTS
