| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KHH5YE32CG |
| EPA CompTox | DTXSID2063395 |
Structure
| InChI Key | JXHHVVMPTVKBGI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H13Br1 |
| Molecular Weight | 164.02 |
| AlogP | 2.96 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4283-80-1 |
| NORMAN SUSDAT | |
| FDA SRS | KHH5YE32CG |
| PubChem | 77968 |
| ChemSpider | 70357.0 |
CONTENTS
