5-Allyl-1,3-Diphenyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
[CAS# 743-45-3]

Identification

• Name: 5-Allyl-1,3-Diphenyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
• Synonyms: 5-Allyl-1,3-Di(Phenyl)Hexahydropyrimidine-2,4,6-Trione; 5-Allyl-1,3-Di(Phenyl)Barbituric Acid; Brn 0558728
• Molecular Formula: C₁₉H₁₆N₂O₃
• Molecular Weight: 320.35
• CAS Registry Number: 743-45-3
• SMILES: C3=C(N2C(N(C1=CC=CC=C1)C(C(C2=O)CC=C)=O)=O)C=CC=C3
• InChI: 1S/C19H16N2O3/c1-2-9-16-17(22)20(14-10-5-3-6-11-14)19(24)21(18(16)23)15-12-7-4-8-13-15/h2-8,10-13,16H,1,9H2
• InChIKey: CSCJXJYSSKSVQF-UHFFFAOYSA-N

Properties

• Density: 1.253g/cm³ (Cal.)
• Boiling point: 447.888°C at 760 mmHg (Cal.)
• Flash point: 191.083°C (Cal.)