| Keyword(s): | Human Metabolites ; Indoor Environment Substances |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID2068632 |
| InChI Key | YLYPIBBGWLKELC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C19H17N3O1 |
| Molecular Weight | 303.14 |
| AlogP | 3.93 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 60.05 |
| Heavy Atoms | 23.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 51325-91-8 |
| NORMAN SUSDAT | |
| PubChem | 93262 |
| ChemSpider | 599702.0 |