| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QE3CA59X6A |
| EPA CompTox | DTXSID00176658 |
| InChI Key | FRFMLDNFLXIDSH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11Cl1N2O4 |
| Molecular Weight | 258.04 |
| AlogP | 3.45 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 86.28 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2213-81-2 |
| NORMAN SUSDAT | |
| FDA SRS | QE3CA59X6A |
| PubChem | 75176 |
| ChemSpider | 67722.0 |