CAS 83-29-4

5-(1-Methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

Description:

5-(1-Methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione, with CAS number 83-29-4, is a chemical compound that belongs to the class of pyrimidinetriones, which are characterized by a pyrimidine ring substituted with keto groups. This compound typically exhibits a white to off-white crystalline appearance and is soluble in polar solvents. It is known for its role as a pharmaceutical intermediate and may possess biological activity, although specific pharmacological properties can vary. The presence of the 1-methylbutyl group contributes to its lipophilicity, potentially influencing its interaction with biological membranes. The compound's structure includes three carbonyl groups, which are indicative of its trione nature, and these functional groups can participate in various chemical reactions, such as nucleophilic attacks or condensation reactions. Safety data should be consulted for handling and exposure guidelines, as with any chemical substance, to ensure proper laboratory practices.

Formula: C₉H₁₄N₂O₃

InChI: InChI=1/C9H14N2O3/c1-3-4-5(2)6-7(12)10-9(14)11-8(6)13/h5-6H,3-4H2,1-2H3,(H2,10,11,12,13,14)

InChI key: InChIKey=QSELDKYOARDOCZ-UHFFFAOYSA-N

SMILES: C(CCC)(C)C1C(=O)NC(=O)NC1=O

Synonyms:

• 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylbutyl)-
• 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylbutyl)- (9CI)
• 5-(1-Methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
• 5-(1-Methylbutyl)barbituric acid
• 5-(pentan-2-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
• Barbituric acid, 5-(1-methylbutyl)-
• Barbituric acid, 5-(1-methylbutyl)- (VAN) (8CI)
• Brn 0187936
• Nsc 92501
• 5-(sec-Pentyl)barbituric acid
• 5-24-09-00156 (Beilstein Handbook Reference)
• 5-(sec-Pentyl)barbituric acid
• 6(1h,3h,5h)-pyrimidinetrione, 5-(1-methylbutyl)-4

5-(sec-Pentyl)barbituric Acid

Controlled Product

CAS: 83-29-4

Formula: C₉H₁₄N₂O₃

Color and Shape: Neat

Molecular weight: 198.22

Ref: TR-P283715