[3-[(5-Nitrofuran-2-yl)methylideneamino]-2-oxo-1,3-diazinan-1-yl]methyl cyclohexanecarboxylate
[CAS# 92950-22-6]

Identification

• Name: [3-[(5-Nitrofuran-2-yl)methylideneamino]-2-oxo-1,3-diazinan-1-yl]methyl cyclohexanecarboxylate
• Synonyms: [3-[(5-Nitro-2-Furyl)Methyleneamino]-2-Oxo-Hexahydropyrimidin-1-Yl]Methyl Cyclohexanecarboxylate; Cyclohexanecarboxylic Acid [3-[(5-Nitro-2-Furyl)Methyleneamino]-2-Oxo-1-Hexahydropyrimidinyl]Methyl Ester; Cyclohexanecarboxylic Acid [2-Keto-3-[(5-Nitro-2-Fur
• Molecular Formula: C₁₇H₂₂N₄O₆
• Molecular Weight: 378.38
• CAS Registry Number: 92950-22-6
• SMILES: C1=C(OC(=C1)[N+]([O-])=O)/C=N/N2C(=O)N(CCC2)COC(=O)C3CCCCC3
• InChI: 1S/C17H22N4O6/c22-16(13-5-2-1-3-6-13)26-12-19-9-4-10-20(17(19)23)18-11-14-7-8-15(27-14)21(24)25/h7-8,11,13H,1-6,9-10,12H2/b18-11+
• InChIKey: YJTSORYJNKURQF-WOJGMQOQSA-N

Properties

• Density: 1.456g/cm³ (Cal.)
• Boiling point: 521.028°C at 760 mmHg (Cal.)
• Flash point: 268.908°C (Cal.)