5-[[4-[Benzylmethylamino]Phenyl]Azo]-1,4-Dimethyl-1H-1,2,4-Triazolium Methyl Sulphate
[CAS# 57583-72-9]

Identification

• Name: 5-[[4-[Benzylmethylamino]Phenyl]Azo]-1,4-Dimethyl-1H-1,2,4-Triazolium Methyl Sulphate
• Synonyms: Benzyl-[4-[(2,4-Dimethyl-3H-1,2,4-Triazol-3-Yl)Azo]Phenyl]-Methyl-Ammonium; Methyl Sulfate; Benzyl-[4-[(2,4-Dimethyl-3H-1,2,4-Triazol-3-Yl)Azo]Phenyl]-Methylammonium; Methyl Sulfate; [4-[(2,4-Dimethyl-3H-1,2,4-Triazol-3-Yl)Diazenyl]Phenyl]-Methyl-(Phenylmethyl)Azanium; Methyl Sulfate
• Molecular Formula: C₁₉H₂₆N₆O₄S
• Molecular Weight: 434.51
• CAS Registry Number: 57583-72-9
• EINECS: 260-833-2
• SMILES: C1=C(C=CC=C1)C[NH+](C2=CC=C(C=C2)N=NC3N(C=NN3C)C)C.CO[S](=O)(=O)[O-]
• InChI: 1S/C18H22N6.CH4O4S/c1-22(13-15-7-5-4-6-8-15)17-11-9-16(10-12-17)20-21-18-23(2)14-19-24(18)3;1-5-6(2,3)4/h4-12,14,18H,13H2,1-3H3;1H3,(H,2,3,4)
• InChIKey: OJOFEQZVVKCEMC-UHFFFAOYSA-N

Properties

• Boiling point: 470.8°C at 760 mmHg (Cal.)
• Flash point: 238.5°C (Cal.)