| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID30949579 |
Structure
| InChI Key | FJNNYLPBIOZVIQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H7Br3O |
| Molecular Weight | 367.8 |
| AlogP | 4.54 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26762-91-4 |
| NORMAN SUSDAT | |
| PubChem | 3015319 |
CONTENTS
