5-Ethyl-5-(1-Methyl-1-Nitroethyl)Barbituric Acid
[CAS# 66968-90-9]

Identification

• Name: 5-Ethyl-5-(1-Methyl-1-Nitroethyl)Barbituric Acid
• Synonyms: 5-Ethyl-5-(1-Methyl-1-Nitro-Ethyl)Hexahydropyrimidine-2,4,6-Trione; 5-Ethyl-5-(1-Methyl-1-Nitroethyl)Hexahydropyrimidine-2,4,6-Trione; 5-Ethyl-5-(1-Methyl-1-Nitro-Ethyl)Barbituric Acid
• Molecular Formula: C₉H₁₃N₃O₅
• Molecular Weight: 243.22
• CAS Registry Number: 66968-90-9
• SMILES: C(C1(C([N+]([O-])=O)(C)C)C(=O)NC(=O)NC1=O)C
• InChI: 1S/C9H13N3O5/c1-4-9(8(2,3)12(16)17)5(13)10-7(15)11-6(9)14/h4H2,1-3H3,(H2,10,11,13,14,15)
• InChIKey: QAMTVHWKBPAGTG-UHFFFAOYSA-N

Properties

• Density: 1.304g/cm³ (Cal.)