| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Z3NF9SSH6K |
| EPA CompTox | DTXSID5060857 |
Structure
| InChI Key | YVXHZKKCZYLQOP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H12 |
| Molecular Weight | 96.09 |
| AlogP | 2.2 |
| Number of Rotational Bond | 3.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 628-71-7 |
| NORMAN SUSDAT | |
| FDA SRS | Z3NF9SSH6K |
| PubChem | 12350 |
| ChemSpider | 11845.0 |
CONTENTS
