3-Methyl-1-(4-Nitrophenyl)-4-[[(Nitro)Oxy]Imino]-1H-Pyrazol-5(4H)-One
[CAS# 63549-42-8]

Identification

• Name: 3-Methyl-1-(4-Nitrophenyl)-4-[[(Nitro)Oxy]Imino]-1H-Pyrazol-5(4H)-One
• Synonyms: [[3-Methyl-1-(4-Nitrophenyl)-5-Oxo-Pyrazol-4-Ylidene]Amino] Nitrate; Nitric Acid [[3-Methyl-1-(4-Nitrophenyl)-5-Oxo-4-Pyrazolylidene]Amino] Ester; Nitric Acid [[5-Keto-3-Methyl-1-(4-Nitrophenyl)Pyrazol-4-Ylidene]Amino] Ester
• Molecular Formula: C₁₀H₇N₅O₆
• Molecular Weight: 293.20
• CAS Registry Number: 63549-42-8
• SMILES: C1=CC(=CC=C1[N+]([O-])=O)N2N=C(C)\C(C2=O)=N/O[N+](=O)[O-]
• InChI: 1S/C10H7N5O6/c1-6-9(12-21-15(19)20)10(16)13(11-6)7-2-4-8(5-3-7)14(17)18/h2-5H,1H3/b12-9+
• InChIKey: XRGPGOJFVLGCGD-FMIVXFBMSA-N

Properties

• Density: 1.72g/cm³ (Cal.)
• Boiling point: 475.278°C at 760 mmHg (Cal.)
• Flash point: 241.24°C (Cal.)