5-Acetyl-3,3-Diethyl-6-Methyl-1,5,8-Triazabicyclo[4.3.0]Nonane-2,4,7,9 -Tetrone
[CAS# 81587-29-3]

Identification

• Name: 5-Acetyl-3,3-Diethyl-6-Methyl-1,5,8-Triazabicyclo[4.3.0]Nonane-2,4,7,9 -Tetrone
• Synonyms: 1-Acetyl-3,3-Diethyl-8A-Methyl-Imidazo[5,1-B]Pyrimidine-2,4,6,8-Tetrone; 1-Acetyl-3,3-Diethyl-8A-Methyl-Imidazo[5,1-B]Pyrimidine-2,4,6,8-Diquinone; 1-Ethanoyl-3,3-Diethyl-8A-Methyl-Imidazo[5,1-B]Pyrimidine-2,4,6,8-Tetrone
• Molecular Formula: C₁₃H₁₇N₃O₅
• Molecular Weight: 295.29
• CAS Registry Number: 81587-29-3
• SMILES: C(C)C1(C(N2C(C)(N(C1=O)C(C)=O)C(NC2=O)=O)=O)CC
• InChI: 1S/C13H17N3O5/c1-5-13(6-2)9(19)15(7(3)17)12(4)8(18)14-11(21)16(12)10(13)20/h5-6H2,1-4H3,(H,14,18,21)
• InChIKey: XXSHHZOEBZURHS-UHFFFAOYSA-N

Properties

• Density: 1.391g/cm³ (Cal.)