| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID5072432 |
Structure
| InChI Key | BGPUSBQKFGABPH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H22O1 |
| Molecular Weight | 218.17 |
| AlogP | 4.68 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 71820-46-7 |
| NORMAN SUSDAT | |
| PubChem | 172904 |
| ChemSpider | 4945935.0 |
CONTENTS
