7-bromo-5-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine
[CAS# 677297-87-9]

Identification

• Name: 7-bromo-5-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine
• Synonyms: "1,2,4-BENZOTRIAZIN-3-Amine, 7-BROMO-5-METHYL-, 1-OXIDE"; 1,2,4-Benzotriazin-3-amine,7-bromo-5-methyl-,1-oxide
• Molecular Formula: C₈H₇BrN₄O
• Molecular Weight: 255.07
• CAS Registry Number: 677297-87-9
• SMILES: [O-][n+]2nc(N)nc1c2cc(Br)cc1C
• InChI: 1S/C8H7BrN4O/c1-4-2-5(9)3-6-7(4)11-8(10)12-13(6)14/h2-3H,1H3,(H2,10,11,12)
• InChIKey: VGFWCCQZFGMAJU-UHFFFAOYSA-N

Properties

• Density: 1.957g/cm³ (Cal.)
• Boiling point: 485.599°C at 760 mmHg (Cal.)
• Flash point: 247.482°C (Cal.)
• Refractive index: 1.776 (Cal.)