N,N',N''-Triphenyl-1,3,5-Triazine-2,4,6-Triamine
[CAS 1973-05-3]

Identification

• Name: N,N',N''-Triphenyl-1,3,5-Triazine-2,4,6-Triamine
• Synonyms: [4,6-Bis(Phenylamino)-S-Triazin-2-Yl]-Phenyl-Amine; N,N',N''-Triphenyl-1,3,5-Triazine-2,4,6-Triamine; N2,N4,N6-Triphenylmelamine
• Molecular Formula: C₂₁H₁₈N₆
• Molecular Weight: 354.41
• CAS Registry Number: 1973-05-3
• EINECS: 217-822-2
• SMILES: C1=CC=CC=C1NC2=NC(=NC(=N2)NC3=CC=CC=C3)NC4=CC=CC=C4
• InChI: 1S/C21H18N6/c1-4-10-16(11-5-1)22-19-25-20(23-17-12-6-2-7-13-17)27-21(26-19)24-18-14-8-3-9-15-18/h1-15H,(H3,22,23,24,25,26,27)
• InChIKey: GGHBKCSNURXPNB-UHFFFAOYSA-N

Properties

• Density: 1.326g/cm³ (Cal.)
• Boiling point: 580.824°C at 760 mmHg (Cal.)
• Flash point: 305.072°C (Cal.)

References

• (1): Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370