2-Bromo-1-(4-Methyl-5-Oxido-1,2,5-Oxadiazol-3-Yl)Ethanone
[CAS# 165067-00-5]

Identification

• Name: 2-Bromo-1-(4-Methyl-5-Oxido-1,2,5-Oxadiazol-3-Yl)Ethanone
• Synonyms: 4-(2-bromoacetyl)-3-methyl-1,2,5-oxadiazole 2-oxide
• Molecular Formula: C₅H₅BrN₂O₃
• Molecular Weight: 221.01
• CAS Registry Number: 165067-00-5
• SMILES: CC1=[N+](ON=C1C(=O)CBr)[O-]
• InChI: 1S/C5H5BrN2O3/c1-3-5(4(9)2-6)7-11-8(3)10/h2H2,1H3
• InChIKey: WMSHXMDWZZUEKB-UHFFFAOYSA-N

Properties

• Density: 2.0±0.1g/cm³ (Cal.)
• Boiling point: 310.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 141.5±30.1°C (Cal.)
• Refractive index: 1.638 (Cal.)