4-(5-Nitrofuran-2-Yl)But-3-En-2-One
[CAS# 3455-61-6]

Identification

• Name: 4-(5-Nitrofuran-2-Yl)But-3-En-2-One
• Synonyms: (E)-4-(5-Nitrofuran-2-Yl)But-3-En-2-One; 4-(5-Nitro-2-Furyl)But-3-En-2-One; (E)-4-(5-Nitro-2-Furyl)But-3-En-2-One
• Molecular Formula: C₈H₇NO₄
• Molecular Weight: 181.15
• CAS Registry Number: 3455-61-6
• SMILES: C1=C(OC(=C1)\C=C\C(=O)C)[N+]([O-])=O
• InChI: 1S/C8H7NO4/c1-6(10)2-3-7-4-5-8(13-7)9(11)12/h2-5H,1H3/b3-2+
• InChIKey: AYSGEAZAKMPTSE-NSCUHMNNSA-N

Properties

• Density: 1.306g/cm³ (Cal.)
• Melting point: 192-195°C (Expl.)
• Boiling point: 317.87°C at 760 mmHg (Cal.)
• Flash point: 146.043°C (Cal.)