3,5-Diphenyl-4H-1,2,4-Triazol-4-Amine
[CAS# 3049-45-4]

Identification

• Name: 3,5-Diphenyl-4H-1,2,4-Triazol-4-Amine
• Synonyms: [3,5-Di(Phenyl)-1,2,4-Triazol-4-Yl]Amine; Bim-0011605.P001; Cbmicro_011722
• Molecular Formula: C₁₄H₁₂N₄
• Molecular Weight: 236.28
• CAS Registry Number: 3049-45-4
• SMILES: C3=C(C1=NN=C([N]1N)C2=CC=CC=C2)C=CC=C3
• InChI: 1S/C14H12N4/c15-18-13(11-7-3-1-4-8-11)16-17-14(18)12-9-5-2-6-10-12/h1-10H,15H2
• InChIKey: DAZAXBYJPXKJJL-UHFFFAOYSA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 471.397°C at 760 mmHg (Cal.)
• Flash point: 238.892°C (Cal.)

References

• (1): Ya-Wen Zhang, Jian-Quan Wang and Lin Cheng . A second orthorhombic polymorph of 3,5-diphenyl-4H-1,2,4-triazol-4-amine , Acta Cryst (2009). E65, o2261Â Â