3-(2-Butylphenyl)-5-(3-Methoxyphenyl)-2H-1,2,4-Triazole
[CAS# 85303-89-5]

Identification

• Name: 3-(2-Butylphenyl)-5-(3-Methoxyphenyl)-2H-1,2,4-Triazole
• Synonyms: 1H-1,2,4-Triazole, 3-(2-Butylphenyl)-5-(3-Methoxyphenyl)-; 3-(O-Butylphenyl)-5-(M-Methoxyphenyl)-S-Triazole; Brn 5602286
• Molecular Formula: C₁₉H₂₁N₃O
• Molecular Weight: 307.39
• CAS Registry Number: 85303-89-5
• SMILES: C1=CC=CC(=C1CCCC)C2=NC(=N[NH]2)C3=CC(=CC=C3)OC
• InChI: 1S/C19H21N3O/c1-3-4-8-14-9-5-6-12-17(14)19-20-18(21-22-19)15-10-7-11-16(13-15)23-2/h5-7,9-13H,3-4,8H2,1-2H3,(H,20,21,22)
• InChIKey: XBYGUXKVAJQXEO-UHFFFAOYSA-N

Properties

• Density: 1.119g/cm³ (Cal.)
• Boiling point: 517.919°C at 760 mmHg (Cal.)
• Flash point: 183.076°C (Cal.)