5-Isopropyl-5-Benzylbarbituric Acid
[CAS# 17013-33-1]

Identification

• Name: 5-Isopropyl-5-Benzylbarbituric Acid
• Synonyms: 5-Isopropyl-5-(Phenylmethyl)Hexahydropyrimidine-2,4,6-Trione; 5-(Benzyl)-5-Isopropyl-Barbituric Acid; 4-24-00-02100 (Beilstein Handbook Reference)
• Molecular Formula: C₁₄H₁₆N₂O₃
• Molecular Weight: 260.29
• CAS Registry Number: 17013-33-1
• SMILES: C1=CC=CC=C1CC2(C(C)C)C(=O)NC(=O)NC2=O
• InChI: 1S/C14H16N2O3/c1-9(2)14(8-10-6-4-3-5-7-10)11(17)15-13(19)16-12(14)18/h3-7,9H,8H2,1-2H3,(H2,15,16,17,18,19)
• InChIKey: UMNUSSWRSRDUIL-UHFFFAOYSA-N

Properties

• Density: 1.2g/cm³ (Cal.)