| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID9066413 |
| InChI Key | MQFREHNTGKNSRH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13N1O4 |
| Molecular Weight | 223.08 |
| AlogP | 2.34 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 61.6 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 18790-57-3 |
| NORMAN SUSDAT | |
| PubChem | 86789 |
| ChemSpider | 78287.0 |