| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | O5PB49F5B1 |
| EPA CompTox | DTXSID90225861 |
| InChI Key | MIDALAPASRDTOZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9Cl2N1O2 |
| Molecular Weight | 233.0 |
| AlogP | 2.75 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 52.32 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 74878-31-2 |
| NORMAN SUSDAT | |
| FDA SRS | O5PB49F5B1 |
| PubChem | 99328 |
| ChemSpider | 89736.0 |