| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8AWU5LAY06 |
| EPA CompTox | DTXSID6027636 |
| InChI Key | HHBZZTKMMLDNDN-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H18O1 |
| Molecular Weight | 130.14 |
| AlogP | 2.6 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6863-58-7 |
| NORMAN SUSDAT | |
| FDA SRS | 8AWU5LAY06 |
| ChemSpider | 21785.0 |