(3E)-4-(Methylamino)-3-Nitro-3-Buten-2-One
[CAS# 213619-75-1]

Identification

• Name: (3E)-4-(Methylamino)-3-Nitro-3-Buten-2-One
• Synonyms: 3-BUTEN-2-ONE, 4-(METHYLAMINO)-3-NITRO-, (3Z)- (9CI)
• Molecular Formula: C₅H₈N₂O₃
• Molecular Weight: 144.13
• CAS Registry Number: 213619-75-1
• SMILES: [O-][N+](=O)C(=C\NC)\C(=O)C
• InChI: 1S/C5H8N2O3/c1-4(8)5(3-6-2)7(9)10/h3,6H,1-2H3/b5-3+
• InChIKey: UPEVPQDBJVDBIA-HWKANZROSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 254.764°C at 760 mmHg (Cal.)
• Flash point: 107.878°C (Cal.)
• Refractive index: 1.476 (Cal.)