| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | HO60EKF2SI |
| EPA CompTox | DTXSID90209681 |
Structure
| InChI Key | PRXDHKJRAGSLNW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H20O1 |
| Molecular Weight | 216.15 |
| AlogP | 3.93 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 60834-82-4 |
| NORMAN SUSDAT | |
| FDA SRS | HO60EKF2SI |
| PubChem | 3017205 |
| ChemSpider | 2284984.0 |
CONTENTS
