| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50146487 |
Structure
| InChI Key | HMENQNSSJFLQOP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H3Br1O2 |
| Molecular Weight | 149.93 |
| AlogP | 0.98 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 10443-65-9 |
| NORMAN SUSDAT | |
| PubChem | 82633 |
| ChemSpider | 74570.0 |
CONTENTS
