| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10663105 |
| InChI Key | NNJIYASXBPPIGU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5Br1F11O1 |
| Molecular Weight | 363.9 |
| AlogP | 4.37 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 16005-49-5 |
| NORMAN SUSDAT | |
| PubChem | 45075722 |
| ChemSpider | 23955839.0 |