| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | X6N46728S9 |
| EPA CompTox | DTXSID5060722 |
| InChI Key | AGUWUIVKDXDKBT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7Cl1O2 |
| Molecular Weight | 170.01 |
| AlogP | 1.83 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 620-73-5 |
| NORMAN SUSDAT | |
| FDA SRS | X6N46728S9 |
| PubChem | 12108 |
| ChemSpider | 11611.0 |