| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID6071453 |
Structure
| InChI Key | SLWIWWNAEFYJIS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H15N1O3 |
| Molecular Weight | 209.11 |
| AlogP | 2.86 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 52.37 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 68368-42-3 |
| NORMAN SUSDAT | |
| PubChem | 110082 |
| ChemSpider | 98861.0 |
CONTENTS
