| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90233047 |
Structure
| InChI Key | ZCOLNYMULWIGPK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5HF9O |
| Molecular Weight | 247.99 |
| AlogP | 3.53 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 84145-18-6 |
| NORMAN SUSDAT | |
| PubChem | 6365941 |
CONTENTS
