| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6S785TC0OB |
| EPA CompTox | DTXSID8052194 |
| InChI Key | YOETUEMZNOLGDB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H9Cl1O2 |
| Molecular Weight | 136.03 |
| AlogP | 2.02 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 543-27-1 |
| NORMAN SUSDAT | |
| FDA SRS | 6S785TC0OB |
| PubChem | 62365 |
| ChemSpider | 56154.0 |