| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10172348 |
| InChI Key | IATZLNCRIIUXJM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H12O2 |
| Molecular Weight | 140.08 |
| AlogP | 1.35 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 18937-78-5 |
| NORMAN SUSDAT | |
| PubChem | 87859 |
| ChemSpider | 79266.0 |