| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3O8L0EWR5Q |
| EPA CompTox | DTXSID6060507 |
| InChI Key | VQFAIAKCILWQPZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C3H5Br1O1 |
| Molecular Weight | 135.95 |
| AlogP | 0.97 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 5.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 598-31-2 |
| NORMAN SUSDAT | |
| FDA SRS | 3O8L0EWR5Q |
| PubChem | 11715 |
| ChemSpider | 11223.0 |