| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | G89113PPP5 |
| EPA CompTox | DTXSID60865995 |
| InChI Key | JOSNYUDSMPILKL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H14O3 |
| Molecular Weight | 146.09 |
| AlogP | 0.57 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 46.53 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 40348-72-9 |
| NORMAN SUSDAT | |
| FDA SRS | G89113PPP5 |
| PubChem | 62908 |