Ethyl 3-Cyano-2-Oxo-1,2-Dihydro-4-Pyridinecarboxylate
[CAS# 108128-37-6]

Identification

• Name: Ethyl 3-Cyano-2-Oxo-1,2-Dihydro-4-Pyridinecarboxylate
• Synonyms: Isonicotinic acid, 3-cyano-1,2-dihydro-2-oxo-, ethyl ester
• Molecular Formula: C₉H₈N₂O₃
• Molecular Weight: 192.17
• CAS Registry Number: 108128-37-6
• SMILES: N#C\C1=C(\C=C/NC1=O)C(=O)OCC
• InChI: 1S/C9H8N2O3/c1-2-14-9(13)6-3-4-11-8(12)7(6)5-10/h3-4H,2H2,1H3,(H,11,12)
• InChIKey: VKNPSXLHUFALKB-UHFFFAOYSA-N

Properties

• Density: 1.305g/cm³ (Cal.)
• Boiling point: 367.572°C at 760 mmHg (Cal.)
• Flash point: 176.102°C (Cal.)
• Refractive index: 1.545 (Cal.)