| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4SW5S1T63S |
| EPA CompTox | DTXSID90886759 |
Structure
| InChI Key | KITGYVIOYOCIIE-QNMAEOQASA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H16O2 |
| Molecular Weight | 168.12 |
| AlogP | 2.46 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 65405-80-3 |
| NORMAN SUSDAT | |
| FDA SRS | 4SW5S1T63S |
| PubChem | 16220110 |
CONTENTS
