| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20932319 |
Structure
| InChI Key | IIVQCYBAMCISPI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H11NO2 |
| Molecular Weight | 141.08 |
| AlogP | 1.24 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 50.09 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 14447-16-6 |
| NORMAN SUSDAT | |
| PubChem | 85736 |
CONTENTS
