5-Allyl-5-Piperonylbarbituric Acid
[CAS# 69353-38-4]

Identification

• Name: 5-Allyl-5-Piperonylbarbituric Acid
• Synonyms: 5-Allyl-5-(1,3-Benzodioxol-5-Ylmethyl)Hexahydropyrimidine-2,4,6-Trione; 5-Allyl-5-(1,3-Benzodioxol-5-Ylmethyl)Barbituric Acid; 4-27-00-08858 (Beilstein Handbook Reference)
• Molecular Formula: C₁₅H₁₄N₂O₅
• Molecular Weight: 302.29
• CAS Registry Number: 69353-38-4
• SMILES: C1=C3C(=CC=C1CC2(C(NC(NC2=O)=O)=O)CC=C)OCO3
• InChI: 1S/C15H14N2O5/c1-2-5-15(12(18)16-14(20)17-13(15)19)7-9-3-4-10-11(6-9)22-8-21-10/h2-4,6H,1,5,7-8H2,(H2,16,17,18,19,20)
• InChIKey: DOIXCQCZFWKGLM-UHFFFAOYSA-N

Properties

• Density: 1.343g/cm³ (Cal.)