| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Q75TYA8L62 |
| EPA CompTox | DTXSID40192211 |
| InChI Key | LVSDLZIEHYYLTC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H12O3 |
| Molecular Weight | 144.08 |
| AlogP | 0.77 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 38923-57-8 |
| NORMAN SUSDAT | |
| FDA SRS | Q75TYA8L62 |
| PubChem | 96925 |
| ChemSpider | 87517.0 |