| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6LB5RD2XU4 |
| EPA CompTox | DTXSID2066191 |
| InChI Key | LQMDOONLLAJAPZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O1 |
| Molecular Weight | 110.07 |
| AlogP | 0.92 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 17356-19-3 |
| NORMAN SUSDAT | |
| FDA SRS | 6LB5RD2XU4 |
| PubChem | 87074 |
| ChemSpider | 78543.0 |