| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10431543 |
Structure
| InChI Key | CVMAOIALLIBNNZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H6Cl2N2O1 |
| Molecular Weight | 191.99 |
| AlogP | 2.18 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 35.01 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 40758-65-4 |
| NORMAN SUSDAT | |
| PubChem | 9837015 |
| ChemSpider | 8012736.0 |
CONTENTS
