| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 98S99P2ILL |
| EPA CompTox | DTXSID0022303 |
| InChI Key | ABQHJSHFFLAGHF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H8Cl2O2 |
| Molecular Weight | 265.99 |
| AlogP | 4.6 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 79124-76-8 |
| NORMAN SUSDAT | |
| FDA SRS | 98S99P2ILL |
| PubChem | 157289 |
| ChemSpider | 138427.0 |