1,3-Diallyl-5-Ethyl-5-Phenylpyrimidine-2,4,6(1H,3H,5H)-Trione
[CAS# 16846-63-2]

Identification

• Name: 1,3-Diallyl-5-Ethyl-5-Phenylpyrimidine-2,4,6(1H,3H,5H)-Trione
• Synonyms: 1,3-Diallyl-5-Ethyl-5-Phenyl-Hexahydropyrimidine-2,4,6-Trione; 1,3-Diallyl-5-Ethyl-5-Phenylhexahydropyrimidine-2,4,6-Trione; 1,3-Diallyl-5-Ethyl-5-Phenyl-Barbituric Acid
• Molecular Formula: C₁₈H₂₀N₂O₃
• Molecular Weight: 312.37
• CAS Registry Number: 16846-63-2
• SMILES: C1=CC=CC=C1C2(C(N(C(N(C2=O)CC=C)=O)CC=C)=O)CC
• InChI: 1S/C18H20N2O3/c1-4-12-19-15(21)18(6-3,14-10-8-7-9-11-14)16(22)20(13-5-2)17(19)23/h4-5,7-11H,1-2,6,12-13H2,3H3
• InChIKey: YFLJPNVUFFTRPL-UHFFFAOYSA-N

Properties

• Density: 1.129g/cm³ (Cal.)
• Boiling point: 421.683°C at 760 mmHg (Cal.)
• Flash point: 171.07°C (Cal.)