| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | UVN42ZC9BD |
| EPA CompTox | DTXSID1062207 |
| InChI Key | BIGQPYZPEWAPBG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12O4 |
| Molecular Weight | 196.07 |
| AlogP | 1.49 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 44.76 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2150-38-1 |
| NORMAN SUSDAT | |
| FDA SRS | UVN42ZC9BD |
| PubChem | 16522 |
| ChemSpider | 15661.0 |