| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | C38517JK47 |
| EPA CompTox | DTXSID20200121 |
Structure
| InChI Key | GMBFNZCPZFVKAT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.08 |
| AlogP | 1.83 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5211-62-1 |
| NORMAN SUSDAT | |
| FDA SRS | C38517JK47 |
| PubChem | 78887 |
| ChemSpider | 71222.0 |
CONTENTS
