| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R3444G4CLN |
| EPA CompTox | DTXSID60180711 |
Structure
| InChI Key | LUTZMJZHVATZQM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H10Br2O |
| Molecular Weight | 255.91 |
| AlogP | 2.86 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26074-53-3 |
| NORMAN SUSDAT | |
| FDA SRS | R3444G4CLN |
| PubChem | 117717 |
CONTENTS
