| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | J8A3D7KH7W |
| EPA CompTox | DTXSID60234304 |
| InChI Key | IQTNMFRCFNHMHF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5Cl3O3 |
| Molecular Weight | 217.93 |
| AlogP | 1.14 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 85153-68-0 |
| NORMAN SUSDAT | |
| FDA SRS | J8A3D7KH7W |
| PubChem | 3020453 |
| ChemSpider | 2287341.0 |