| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50978508 |
| InChI Key | DJTJGNJDSIOAOS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H12NO4 |
| Molecular Weight | 197.07 |
| AlogP | 1.62 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 61.6 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 62819-95-8 |
| NORMAN SUSDAT | |
| PubChem | 3017361 |