| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KAV4DL6BPX |
| EPA CompTox | DTXSID9070668 |
| InChI Key | SAZOOWOGQNYJLS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H5Cl1O4 |
| Molecular Weight | 187.99 |
| AlogP | 1.45 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 77.76 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 67828-44-8 |
| NORMAN SUSDAT | |
| FDA SRS | KAV4DL6BPX |
| PubChem | 105728 |
| ChemSpider | 95292.0 |