5-Ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione mixt. with 3-ethyl-3-phenyl-2,6-piperidinedione
[CAS# 52623-89-9]

Identification

• Name: 5-Ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione mixt. with 3-ethyl-3-phenyl-2,6-piperidinedione
• Synonyms: 5-Ethyl-5-Isopentyl-Hexahydropyrimidine-2,4,6-Trione; 3-Ethyl-3-Phenyl-Piperidine-2,6-Dione; 5-Ethyl-5-Isopentylhexahydropyrimidine-2,4,6-Trione; 3-Ethyl-3-Phenylpiperidine-2,6-Dione; 5-Ethyl-5-Isoamyl-Barbituric Acid; 3-Ethyl-3-Phenyl-Piperidine-2,6-Quinone
• Molecular Formula: C₂₄H₃₃N₃O₅
• Molecular Weight: 443.54
• CAS Registry Number: 52623-89-9
• SMILES: C(C1(C(=O)NC(=O)NC1=O)CC)CC(C)C.C3=C(C2(C(=O)NC(=O)CC2)CC)C=CC=C3
• InChI: 1S/C13H15NO2.C11H18N2O3/c1-2-13(10-6-4-3-5-7-10)9-8-11(15)14-12(13)16;1-4-11(6-5-7(2)3)8(14)12-10(16)13-9(11)15/h3-7H,2,8-9H2,1H3,(H,14,15,16);7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
• InChIKey: JXKIQTRZRXKFHM-UHFFFAOYSA-N

Properties

• Boiling point: 599.4°C at 760 mmHg (Cal.)
• Flash point: 165.2°C (Cal.)