5,5-Diethyl-1-Isopentylbarbituric Acid
[CAS# 66940-87-2]

Identification

• Name: 5,5-Diethyl-1-Isopentylbarbituric Acid
• Synonyms: 5,5-Diethyl-1-Isopentyl-Hexahydropyrimidine-2,4,6-Trione; 5,5-Diethyl-1-Isopentylhexahydropyrimidine-2,4,6-Trione; 5,5-Diethyl-1-Isoamyl-Barbituric Acid
• Molecular Formula: C₁₃H₂₂N₂O₃
• Molecular Weight: 254.33
• CAS Registry Number: 66940-87-2
• SMILES: C(C1(C(N(C(NC1=O)=O)CCC(C)C)=O)CC)C
• InChI: 1S/C13H22N2O3/c1-5-13(6-2)10(16)14-12(18)15(11(13)17)8-7-9(3)4/h9H,5-8H2,1-4H3,(H,14,16,18)
• InChIKey: ANRPSQFFIAOJMI-UHFFFAOYSA-N

Properties

• Density: 1.042g/cm³ (Cal.)