| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 50T4JF2H1K |
| EPA CompTox | DTXSID3058872 |
| InChI Key | TUZZWPYZPHNFJY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H7Cl1O3 |
| Molecular Weight | 258.01 |
| AlogP | 2.82 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 54.37 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 82-42-8 |
| NORMAN SUSDAT | |
| FDA SRS | 50T4JF2H1K |
| PubChem | 66510 |
| ChemSpider | 59881.0 |