| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 536PC64795 |
| EPA CompTox | DTXSID7027546 |
Structure
| InChI Key | IBVPVTPPYGGAEL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H14 |
| Molecular Weight | 158.11 |
| AlogP | 3.75 |
| Number of Rotational Bond | 2.0 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3748-13-8 |
| NORMAN SUSDAT | |
| FDA SRS | 536PC64795 |
| PubChem | 77353 |
| ChemSpider | 69770.0 |
CONTENTS
