5-Sec-Butyl-1,3-Dicyclohexyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
[CAS# 745-31-3]

Identification

• Name: 5-Sec-Butyl-1,3-Dicyclohexyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
• Synonyms: 1,3-Dicyclohexyl-5-Sec-Butyl-Hexahydropyrimidine-2,4,6-Trione; 1,3-Dicyclohexyl-5-Sec-Butylhexahydropyrimidine-2,4,6-Trione; 1,3-Dicyclohexyl-5-Sec-Butyl-Barbituric Acid
• Molecular Formula: C₂₀H₃₂N₂O₃
• Molecular Weight: 348.48
• CAS Registry Number: 745-31-3
• SMILES: C(C(C2C(N(C(N(C1CCCCC1)C2=O)=O)C3CCCCC3)=O)C)C
• InChI: 1S/C20H32N2O3/c1-3-14(2)17-18(23)21(15-10-6-4-7-11-15)20(25)22(19(17)24)16-12-8-5-9-13-16/h14-17H,3-13H2,1-2H3
• InChIKey: GUIGEQUDNHREDY-UHFFFAOYSA-N

Properties

• Density: 1.135g/cm³ (Cal.)
• Boiling point: 453.883°C at 760 mmHg (Cal.)
• Flash point: 177.107°C (Cal.)