| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | LTS99E7XKQ |
| EPA CompTox | DTXSID90193612 |
| InChI Key | CNLYNLSYCPWZQY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7Cl1O1 |
| Molecular Weight | 178.02 |
| AlogP | 3.2 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 40604-49-7 |
| NORMAN SUSDAT | |
| FDA SRS | LTS99E7XKQ |
| PubChem | 96496 |
| ChemSpider | 87113.0 |