| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Q3Z845166M |
| EPA CompTox | DTXSID40196754 |
Structure
| InChI Key | QKHROXOPRBWBDD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H5Br3O1 |
| Molecular Weight | 341.79 |
| AlogP | 3.99 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4619-74-3 |
| NORMAN SUSDAT | |
| FDA SRS | Q3Z845166M |
| PubChem | 20737 |
| ChemSpider | 19526.0 |
CONTENTS
