| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6H2A01VER0 |
| EPA CompTox | DTXSID8041296 |
Structure
| InChI Key | LGURYBCSJPXHTF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H12Cl2O3 |
| Molecular Weight | 310.02 |
| AlogP | 4.23 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 20.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 94-83-7 |
| NORMAN SUSDAT | |
| FDA SRS | 6H2A01VER0 |
| PubChem | 7208 |
| ChemSpider | 6939.0 |
CONTENTS
