| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E894DK6G3L |
| EPA CompTox | DTXSID6063430 |
Structure
| InChI Key | LEBHHJDUAJKLKG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.1 |
| AlogP | 1.99 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4360-60-5 |
| NORMAN SUSDAT | |
| FDA SRS | E894DK6G3L |
| PubChem | 64811 |
| ChemSpider | 58343.0 |
CONTENTS
