| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | C8X48TPW7E |
| EPA CompTox | DTXSID9061910 |
Structure
| InChI Key | JNPNJMJXGPZCNE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H16O1 |
| Molecular Weight | 164.12 |
| AlogP | 2.96 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1712-74-9 |
| NORMAN SUSDAT | |
| FDA SRS | C8X48TPW7E |
| PubChem | 74383 |
| ChemSpider | 66976.0 |
CONTENTS
