| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | I8Q0YN919K |
| EPA CompTox | DTXSID90210333 |
| InChI Key | LOFDXZJSDVCYAS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H8O3 |
| Molecular Weight | 140.05 |
| AlogP | 1.46 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 39.44 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 614-98-2 |
| NORMAN SUSDAT | |
| FDA SRS | I8Q0YN919K |
| PubChem | 69201 |
| ChemSpider | 11485.0 |