| Keyword(s): | Plastic additives ; Food Contact Chemicals |
| Molecule Category | Free-form |
| UNII | 647UP45J2U |
| EPA CompTox | DTXSID5027198 |
| InChI Key | ZXLYYQUMYFHCLQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H7N1O2 |
| Molecular Weight | 161.05 |
| AlogP | 0.91 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 37.38 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 550-44-7 |
| NORMAN SUSDAT | |
| FDA SRS | 647UP45J2U |
| PubChem | 11074 |
| ChemSpider | 10603.0 |