| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 02X6KNJ5EE |
| EPA CompTox | DTXSID0026098 |
Structure
| InChI Key | XQTLDIFVVHJORV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H1Cl4N1O2 |
| Molecular Weight | 258.88 |
| AlogP | 4.21 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 43.14 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 117-18-0 |
| NORMAN SUSDAT | |
| FDA SRS | 02X6KNJ5EE |
| PubChem | 8330 |
| ChemSpider | 21106573.0 |
CONTENTS
