| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 978DN6CD4N |
| EPA CompTox | DTXSID00149948 |
Structure
| InChI Key | KMQVCYOPBMKRKH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N1O1 |
| Molecular Weight | 123.07 |
| AlogP | 0.94 |
| Hydrogen Bond Acceptor | 1.0 |
| Polar Surface Area | 26.94 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1122-45-8 |
| NORMAN SUSDAT | |
| FDA SRS | 978DN6CD4N |
| PubChem | 70733 |
| ChemSpider | 63898.0 |
CONTENTS
