| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7902N03BH0 |
| EPA CompTox | DTXSID5041774 |
| InChI Key | ATAJVFBUUIBIEO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9Cl1O1 |
| Molecular Weight | 168.03 |
| AlogP | 2.53 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 145-94-8 |
| NORMAN SUSDAT | |
| FDA SRS | 7902N03BH0 |