| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CF3F7MAQ35 |
| EPA CompTox | DTXSID0059110 |
| InChI Key | XPKFTIYOZUJAGA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H15N1O2 |
| Molecular Weight | 181.11 |
| AlogP | 2.07 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 44.48 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 94-85-9 |
| NORMAN SUSDAT | |
| FDA SRS | CF3F7MAQ35 |
| PubChem | 66756 |
| ChemSpider | 60122.0 |