| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID2051847 |
Structure
| InChI Key | SSNZFFBDIMUILS-ZHACJKMWSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H22O |
| Molecular Weight | 182.17 |
| AlogP | 3.88 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 20407-84-5 |
| NORMAN SUSDAT |
CONTENTS
