| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2Q750587K8 |
| EPA CompTox | DTXSID8065743 |
Structure
| InChI Key | XGNXYCFREOZBOL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7N1O2 |
| Molecular Weight | 137.05 |
| AlogP | 1.0 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 44.48 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 14268-66-7 |
| NORMAN SUSDAT | |
| FDA SRS | 2Q750587K8 |
| PubChem | 84310 |
| ChemSpider | 76055.0 |
CONTENTS
