1-(4-Acetyloxycyclohexyl)-5-Methylbarbituric Acid
[CAS# 4394-23-4]

Identification

• Name: 1-(4-Acetyloxycyclohexyl)-5-Methylbarbituric Acid
• Synonyms: [4-(5-Methyl-2,4,6-Trioxo-Hexahydropyrimidin-1-Yl)Cyclohexyl] Acetate; Acetic Acid [4-(5-Methyl-2,4,6-Trioxo-1-Hexahydropyrimidinyl)Cyclohexyl] Ester; Acetic Acid [4-(2,4,6-Triketo-5-Methyl-Hexahydropyrimidin-1-Yl)Cyclohexyl] Ester
• Molecular Formula: C₁₃H₁₈N₂O₅
• Molecular Weight: 282.30
• CAS Registry Number: 4394-23-4
• SMILES: CC1C(NC(N(C1=O)C2CCC(CC2)OC(=O)C)=O)=O
• InChI: 1S/C13H18N2O5/c1-7-11(17)14-13(19)15(12(7)18)9-3-5-10(6-4-9)20-8(2)16/h7,9-10H,3-6H2,1-2H3,(H,14,17,19)
• InChIKey: KTWAKIZSPUJCDX-UHFFFAOYSA-N

Properties

• Density: 1.307g/cm³ (Cal.)