| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZGH9CA1BFI |
| EPA CompTox | DTXSID90209868 |
Structure
| InChI Key | KDUWXMIHHIVXER-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H10O2 |
| Molecular Weight | 150.07 |
| AlogP | 1.98 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 610-99-1 |
| NORMAN SUSDAT | |
| FDA SRS | ZGH9CA1BFI |
| PubChem | 69133 |
| ChemSpider | 62349.0 |
CONTENTS
