| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 935K0CS3JR |
| EPA CompTox | DTXSID3074494 |
Structure
| InChI Key | LOOAGTDYKNUDBZ-UXBLZVDNSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H10Br1Cl2O4P1 |
| Molecular Weight | 373.89 |
| AlogP | 5.1 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 44.76 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13104-21-7 |
| NORMAN SUSDAT | |
| FDA SRS | 935K0CS3JR |
| PubChem | 6107844 |
| ChemSpider | 4811896.0 |
CONTENTS
