| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E6NVH6VQ3D |
| EPA CompTox | DTXSID1060425 |
| InChI Key | NIDWUZTTXGJFNN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H11Br1O1 |
| Molecular Weight | 214.0 |
| AlogP | 2.85 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 588-63-6 |
| NORMAN SUSDAT | |
| FDA SRS | E6NVH6VQ3D |
| PubChem | 68522 |
| ChemSpider | 7360.0 |