5-Ethyl-5-Isopentyl-1-Phenylbarbituric Acid
[CAS# 66968-55-6]

Identification

• Name: 5-Ethyl-5-Isopentyl-1-Phenylbarbituric Acid
• Synonyms: 5-Ethyl-5-Isopentyl-1-Phenyl-Hexahydropyrimidine-2,4,6-Trione; 5-Ethyl-5-Isopentyl-1-Phenylhexahydropyrimidine-2,4,6-Trione; 5-Ethyl-5-Isoamyl-1-Phenyl-Barbituric Acid
• Molecular Formula: C₁₇H₂₂N₂O₃
• Molecular Weight: 302.37
• CAS Registry Number: 66968-55-6
• SMILES: C2=C(N1C(=O)C(CCC(C)C)(CC)C(=O)NC1=O)C=CC=C2
• InChI: 1S/C17H22N2O3/c1-4-17(11-10-12(2)3)14(20)18-16(22)19(15(17)21)13-8-6-5-7-9-13/h5-9,12H,4,10-11H2,1-3H3,(H,18,20,22)
• InChIKey: YEAUIGJGKUKBDE-UHFFFAOYSA-N

Properties

• Density: 1.117g/cm³ (Cal.)