5,5-Diethyl-1-(1,1-Dimethylpropyl)Barbituric Acid
[CAS# 66940-81-6]

Identification

• Name: 5,5-Diethyl-1-(1,1-Dimethylpropyl)Barbituric Acid
• Synonyms: 1-(1,1-Dimethylpropyl)-5,5-Diethyl-Hexahydropyrimidine-2,4,6-Trione; 1-(1,1-Dimethylpropyl)-5,5-Diethylhexahydropyrimidine-2,4,6-Trione; 1-Tert-Amyl-5,5-Diethyl-Barbituric Acid
• Molecular Formula: C₁₃H₂₂N₂O₃
• Molecular Weight: 254.33
• CAS Registry Number: 66940-81-6
• SMILES: C(C1(C(N(C(NC1=O)=O)C(CC)(C)C)=O)CC)C
• InChI: 1S/C13H22N2O3/c1-6-12(4,5)15-10(17)13(7-2,8-3)9(16)14-11(15)18/h6-8H2,1-5H3,(H,14,16,18)
• InChIKey: FTNKYOPECSBLHC-UHFFFAOYSA-N

Properties

• Density: 1.062g/cm³ (Cal.)