5-Allyl-5-Ethyl-2-Thioxodihydro-4,6(1H,5H)-Pyrimidinedione
[CAS# 500534-89-4]

Identification

• Name: 5-Allyl-5-Ethyl-2-Thioxodihydro-4,6(1H,5H)-Pyrimidinedione
• Synonyms: 2-Triobarbituric acid, 5-allyl-5-ethyl-; 5-Allyl-5-ethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione #; 5-allyl-5-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
• Molecular Formula: C₉H₁₂N₂O₂S
• Molecular Weight: 212.27
• CAS Registry Number: 500534-89-4
• SMILES: CCC1(C(=O)NC(=S)NC1=O)CC=C
• InChI: 1S/C9H12N2O2S/c1-3-5-9(4-2)6(12)10-8(14)11-7(9)13/h3H,1,4-5H2,2H3,(H2,10,11,12,13,14)
• InChIKey: UWDYLKHIZYMJSU-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Refractive index: 1.576 (Cal.)