| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | X4S5ED5MQ6 |
| EPA CompTox | DTXSID90207965 |
Structure
| InChI Key | HXKLFOFTXZZNNA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7Br3 |
| Molecular Weight | 339.81 |
| AlogP | 4.15 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 59216-17-0 |
| NORMAN SUSDAT | |
| FDA SRS | X4S5ED5MQ6 |
| PubChem | 100985 |
| ChemSpider | 91235.0 |
CONTENTS
