| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3K95NM9ZHZ |
| EPA CompTox | DTXSID80228306 |
Structure
| InChI Key | FIBBFBXFASKAON-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H3Cl2N1O1 |
| Molecular Weight | 198.96 |
| AlogP | 2.7 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 40.86 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 77668-42-9 |
| NORMAN SUSDAT | |
| FDA SRS | 3K95NM9ZHZ |
| PubChem | 2735968 |
| ChemSpider | 2017649.0 |
CONTENTS
