2-[(1E,3E)-4-(5-Nitrofuran-2-Yl)Buta-1,3-Dienyl]Quinoline-4-Carboxylic Acid
[CAS# 31432-65-2]

Identification

• Name: 2-[(1E,3E)-4-(5-Nitrofuran-2-Yl)Buta-1,3-Dienyl]Quinoline-4-Carboxylic Acid
• Synonyms: 2-[(1E,3E)-4-(5-Nitro-2-Furyl)Buta-1,3-Dienyl]Quinoline-4-Carboxylic Acid; 2-[(1E,3E)-4-(5-Nitro-2-Furyl)Buta-1,3-Dienyl]-4-Quinolinecarboxylic Acid; 2-[(1E,3E)-4-(5-Nitro-2-Furyl)Buta-1,3-Dienyl]Cinchoninic Acid
• Molecular Formula: C₁₈H₁₂N₂O₅
• Molecular Weight: 336.30
• CAS Registry Number: 31432-65-2
• SMILES: C1=C(N=C2C(=C1C(=O)O)C=CC=C2)\C=C\C=C\C3=CC=C(O3)[N+]([O-])=O
• InChI: 1S/C18H12N2O5/c21-18(22)15-11-12(19-16-8-4-3-7-14(15)16)5-1-2-6-13-9-10-17(25-13)20(23)24/h1-11H,(H,21,22)/b5-1+,6-2+
• InChIKey: UUMZAIXYAMIKRH-IJIVKGSJSA-N

Properties

• Density: 1.439g/cm³ (Cal.)
• Boiling point: 589.186°C at 760 mmHg (Cal.)
• Flash point: 310.129°C (Cal.)