| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9KCH96UG6H |
| EPA CompTox | DTXSID70190861 |
Structure
| InChI Key | BEFDCLMNVWHSGT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H12 |
| Molecular Weight | 96.09 |
| AlogP | 2.36 |
| Number of Rotational Bond | 1.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3742-34-5 |
| NORMAN SUSDAT | |
| FDA SRS | 9KCH96UG6H |
| PubChem | 77345 |
| ChemSpider | 69762.0 |
CONTENTS
