| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CBK7Y28SP3 |
Structure
| InChI Key | OCSOHUROTFFTFO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H11NO3 |
| Molecular Weight | 181.07 |
| AlogP | 1.23 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 73.54 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 94-35-9 |
| NORMAN SUSDAT | |
| FDA SRS | CBK7Y28SP3 |
| PubChem | 7186 |
CONTENTS
