1-[4-(4-Methyl-1(4H)-pyrazinyl)-3-nitrophenyl]ethanone
[CAS# 887595-37-1]

Identification

• Name: 1-[4-(4-Methyl-1(4H)-pyrazinyl)-3-nitrophenyl]ethanone
• Synonyms: 1-[4-(4-Methyl-1(4H)-pyrazinyl)-3-nitrophenyl]ethanon; 1-[4-(4-Methyl-1(4H)-pyrazinyl)-3-nitrophenyl]ethanone; 1-[4-(4-Méthyl-1(4H)-pyrazinyl)-3-nitrophényl]éthanone
• Molecular Formula: C₁₃H₁₃N₃O₃
• Molecular Weight: 259.26
• CAS Registry Number: 887595-37-1
• SMILES: CC(=O)c1ccc(c(c1)[N+](=O)[O-])N2C=CN(C=C2)C
• InChI: 1S/C13H13N3O3/c1-10(17)11-3-4-12(13(9-11)16(18)19)15-7-5-14(2)6-8-15/h3-9H,1-2H3
• InChIKey: SSEYVQNJEKFJCO-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 378.3±42.0°C at 760 mmHg (Cal.)
• Flash point: 182.6±27.9°C (Cal.)
• Refractive index: 1.612 (Cal.)