| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 03KW6RT30C |
| EPA CompTox | DTXSID7074539 |
| InChI Key | LTQJFLVGNGVJCX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H7Cl3O1 |
| Molecular Weight | 271.96 |
| AlogP | 5.02 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 14962-28-8 |
| NORMAN SUSDAT | |
| FDA SRS | 03KW6RT30C |
| PubChem | 105036 |
| ChemSpider | 94773.0 |