| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5Y25PZR32U |
| EPA CompTox | DTXSID2073194 |
| InChI Key | KUMXLFIBWFCMOJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H18 |
| Molecular Weight | 114.14 |
| AlogP | 3.22 |
| Number of Rotational Bond | 3.0 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 563-16-6 |
| NORMAN SUSDAT | |
| FDA SRS | 5Y25PZR32U |
| PubChem | 11233 |
| ChemSpider | 10759.0 |