| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9DOW362Q29 |
| EPA CompTox | DTXSID1045245 |
Structure
| InChI Key | YGCODSQDUUUKIV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H5Cl1N2O1 |
| Molecular Weight | 168.01 |
| AlogP | 1.89 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 52.78 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 61-80-3 |
| NORMAN SUSDAT | |
| FDA SRS | 9DOW362Q29 |
| PubChem | 6103 |
| ChemSpider | 5878.0 |
CONTENTS
