| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | M4UC9NR9A2 |
| EPA CompTox | DTXSID80181063 |
Structure
| InChI Key | WQSCTLOEMUQLLZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H11BrO |
| Molecular Weight | 178.0 |
| AlogP | 2.34 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26464-06-2 |
| NORMAN SUSDAT | |
| FDA SRS | M4UC9NR9A2 |
| PubChem | 3015278 |
CONTENTS
