| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8052190 |
| InChI Key | UIHGITHJVWASPE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H15N1 |
| Molecular Weight | 173.12 |
| AlogP | 3.17 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 54089-83-7 |
| NORMAN SUSDAT | |
| PubChem | 103875 |
| ChemSpider | 93784.0 |