| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | N0U8S29G6E |
| EPA CompTox | DTXSID3040699 |
Structure
| InChI Key | YIOCIFXUGBYCJR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H10Cl2O2 |
| Molecular Weight | 280.01 |
| AlogP | 4.21 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 83-05-6 |
| NORMAN SUSDAT | |
| FDA SRS | N0U8S29G6E |
| PubChem | 6730 |
| ChemSpider | 6474.0 |
CONTENTS
