| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NT7RH7KLX4 |
| EPA CompTox | DTXSID10232411 |
Structure
| InChI Key | MNELLQACUSWKSP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H14O2 |
| Molecular Weight | 214.1 |
| AlogP | 3.27 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 835-79-0 |
| NORMAN SUSDAT | |
| FDA SRS | NT7RH7KLX4 |
| PubChem | 70041 |
CONTENTS
