N-(2-Acetoxyethyl)-N-[(1-Methyl-2-Nitro-1H-Imidazol-5-Yl)Methylene]Amine Oxide
[CAS# 63958-44-1]

Identification

• Name: N-(2-Acetoxyethyl)-N-[(1-Methyl-2-Nitro-1H-Imidazol-5-Yl)Methylene]Amine Oxide
• Synonyms: N-(2-Acetoxyethyl)-1-(3-Methyl-2-Nitro-Imidazol-4-Yl)Methanimine Oxide; N-(2-Acetoxyethyl)-1-(3-Methyl-2-Nitro-4-Imidazolyl)Methanimine Oxide; N-(2-Acetyloxyethyl)-1-(3-Methyl-2-Nitro-Imidazol-4-Yl)Methanimine Oxide
• Molecular Formula: C₉H₁₂N₄O₅
• Molecular Weight: 256.22
• CAS Registry Number: 63958-44-1
• SMILES: C1=C([N](C(=N1)[N+]([O-])=O)C)C=[N+]([O-])CCOC(=O)C
• InChI: 1S/C9H12N4O5/c1-7(14)18-4-3-12(15)6-8-5-10-9(11(8)2)13(16)17/h5-6H,3-4H2,1-2H3
• InChIKey: XVMSCXOCZHMJPY-UHFFFAOYSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 514.575°C at 760 mmHg (Cal.)
• Flash point: 265.005°C (Cal.)