5-Allyl-1-Methyl-5-(1-Methylbutyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione
[CAS# 59547-54-5]

Identification

• Name: 5-Allyl-1-Methyl-5-(1-Methylbutyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione
• Synonyms: 5-Allyl-1-Methyl-5-(1-Methylbutyl)Hexahydropyrimidine-2,4,6-Trione; 5-Allyl-1-Methyl-5-(1-Methylbutyl)Barbituric Acid; 4-24-00-02014 (Beilstein Handbook Reference)
• Molecular Formula: C₁₃H₂₀N₂O₃
• Molecular Weight: 252.31
• CAS Registry Number: 59547-54-5
• SMILES: C(C1(C(N(C(=O)NC1=O)C)=O)C(CCC)C)C=C
• InChI: 1S/C13H20N2O3/c1-5-7-9(3)13(8-6-2)10(16)14-12(18)15(4)11(13)17/h6,9H,2,5,7-8H2,1,3-4H3,(H,14,16,18)
• InChIKey: MIBYOIHMKQTMKM-UHFFFAOYSA-N

Properties

• Density: 1.07g/cm³ (Cal.)