| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NI022UOH8G |
| EPA CompTox | DTXSID8025250 |
Structure
| InChI Key | CYYDNXCYDWWSPS-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5Cl3O1 |
| Molecular Weight | 173.94 |
| AlogP | 2.15 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 12.53 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3083-25-8 |
| NORMAN SUSDAT | |
| FDA SRS | NI022UOH8G |
| ChemSpider | 17304.0 |
CONTENTS
