| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | TRJ2SXT894 |
| EPA CompTox | DTXSID3061188 |
| InChI Key | IGARGHRYKHJQSM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H16 |
| Molecular Weight | 160.13 |
| AlogP | 3.73 |
| Number of Rotational Bond | 1.0 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 827-52-1 |
| NORMAN SUSDAT | |
| FDA SRS | TRJ2SXT894 |
| PubChem | 13229 |
| ChemSpider | 12674.0 |