5-Prop-2-Enyl-1,3-Diazinane-2,4,6-Trione
[CAS# 2565-43-7]

Identification

• Name: 5-Prop-2-Enyl-1,3-Diazinane-2,4,6-Trione
• Synonyms: 5-Allylhexahydropyrimidine-2,4,6-Trione; 5-Allylbarbituric Acid; 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2-Propenyl)-
• Molecular Formula: C₇H₈N₂O₃
• Molecular Weight: 168.15
• CAS Registry Number: 2565-43-7
• EINECS: 219-893-5
• SMILES: C(C1C(NC(NC1=O)=O)=O)C=C
• InChI: 1S/C7H8N2O3/c1-2-3-4-5(10)8-7(12)9-6(4)11/h2,4H,1,3H2,(H2,8,9,10,11,12)
• InChIKey: JLXDSDWQIIJSHV-UHFFFAOYSA-N

Properties

• Density: 1.226g/cm³ (Cal.)

References

• (1): G. S. Nichol and W. Clegg. 5-(1-Methylbutyl)-5-propenylbarbituric acid (quinal barbitone), Acta Cryst. (2007). E63, o1632-o1634