1,3,5-Triphenylbarbituric Acid
[CAS# 5167-31-7]

Identification

• Name: 1,3,5-Triphenylbarbituric Acid
• Synonyms: 1,3,5-Tri(Phenyl)Hexahydropyrimidine-2,4,6-Trione; 1,3,5-Tri(Phenyl)Barbituric Acid; Cds1_000750
• Molecular Formula: C₂₂H₁₆N₂O₃
• Molecular Weight: 356.38
• CAS Registry Number: 5167-31-7
• SMILES: C1=CC=CC=C1C3C(N(C2=CC=CC=C2)C(=O)N(C3=O)C4=CC=CC=C4)=O
• InChI: 1S/C22H16N2O3/c25-20-19(16-10-4-1-5-11-16)21(26)24(18-14-8-3-9-15-18)22(27)23(20)17-12-6-2-7-13-17/h1-15,19H
• InChIKey: WZQPYEJQKDEYJQ-UHFFFAOYSA-N

Properties

• Density: 1.317g/cm³ (Cal.)
• Boiling point: 514.623°C at 760 mmHg (Cal.)
• Flash point: 227.142°C (Cal.)