5-Sec-Butyl-1,3-Dimethyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
[CAS# 7391-63-1]

Identification

• Name: 5-Sec-Butyl-1,3-Dimethyl-2,4,6(1H,3H,5H)-Pyrimidinetrione
• Synonyms: 1,3-Dimethyl-5-Sec-Butyl-Hexahydropyrimidine-2,4,6-Trione; 1,3-Dimethyl-5-Sec-Butylhexahydropyrimidine-2,4,6-Trione; 1,3-Dimethyl-5-Sec-Butyl-Barbituric Acid
• Molecular Formula: C₁₀H₁₆N₂O₃
• Molecular Weight: 212.25
• CAS Registry Number: 7391-63-1
• SMILES: C(C(C1C(N(C(N(C1=O)C)=O)C)=O)C)C
• InChI: 1S/C10H16N2O3/c1-5-6(2)7-8(13)11(3)10(15)12(4)9(7)14/h6-7H,5H2,1-4H3
• InChIKey: LXEIFFQUCUFHQP-UHFFFAOYSA-N

Properties

• Density: 1.137g/cm³ (Cal.)
• Boiling point: 281.838°C at 760 mmHg (Cal.)
• Flash point: 108.807°C (Cal.)