| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R9K49A127H |
| EPA CompTox | DTXSID30195857 |
Structure
| InChI Key | IGVPBCZDHMIOJH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.08 |
| AlogP | 2.39 |
| 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 | 4346-18-3 |
| NORMAN SUSDAT | |
| FDA SRS | R9K49A127H |
| PubChem | 20354 |
| ChemSpider | 19172.0 |
CONTENTS
