Ethyl 5-Cyano-2-Phenyl-6-Thioxo-1,6-Dihydro-3-Pyridinecarboxylate
[CAS# 113858-92-7]

Identification

• Name: Ethyl 5-Cyano-2-Phenyl-6-Thioxo-1,6-Dihydro-3-Pyridinecarboxylate
• Synonyms: ethyl 5-cyano-2-phenyl-6-thioxo-1,6-dihydro-3-pyridinecarboxylate; MFCD01315277
• Molecular Formula: C₁₅H₁₂N₂O₂S
• Molecular Weight: 284.33
• CAS Registry Number: 113858-92-7
• SMILES: N#C\C2=C\C(=C(\c1ccccc1)NC2=S)C(=O)OCC
• InChI: 1S/C15H12N2O2S/c1-2-19-15(18)12-8-11(9-16)14(20)17-13(12)10-6-4-3-5-7-10/h3-8H,2H2,1H3,(H,17,20)
• InChIKey: QOLNBYNAHJUQKG-UHFFFAOYSA-N

Properties

• Density: 1.322g/cm³ (Cal.)
• Melting point: 170-175°C (Expl.)
• Boiling point: 403.082°C at 760 mmHg (Cal.)
• Flash point: 197.577°C (Cal.)
• Refractive index: 1.646 (Cal.)