| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MHG8T9R4PD |
| EPA CompTox | DTXSID40211774 |
Structure
| InChI Key | WEPNJTDVIIKRIK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H16 |
| Molecular Weight | 112.13 |
| AlogP | 3.14 |
| Number of Rotational Bond | 3.0 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 627-97-4 |
| NORMAN SUSDAT | |
| FDA SRS | MHG8T9R4PD |
| PubChem | 12330 |
| ChemSpider | 11825.0 |
CONTENTS
