| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3KA2P78NH7 |
| EPA CompTox | DTXSID90195378 |
Structure
| InChI Key | OVJKFJDEVKABNF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H14O1 |
| Molecular Weight | 174.1 |
| AlogP | 3.78 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 13.14 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4265-27-4 |
| NORMAN SUSDAT | |
| FDA SRS | 3KA2P78NH7 |
| PubChem | 77951 |
| ChemSpider | 70341.0 |
CONTENTS
