| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 780WTB733S |
| EPA CompTox | DTXSID2029587 |
| InChI Key | KAUWEMQJFDRELR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9Cl3O1 |
| Molecular Weight | 201.97 |
| AlogP | 2.42 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 145556-04-3 |
| NORMAN SUSDAT | |
| FDA SRS | 780WTB733S |
| PubChem | 86254 |
| ChemSpider | 77797.0 |