3-(2-Propyn-1-yl)-2,4(1H,3H)-pyrimidinedione
[CAS# 680575-04-6]

Identification

• Name: 3-(2-Propyn-1-yl)-2,4(1H,3H)-pyrimidinedione
• Synonyms: 3-(prop-2-yn-1-yl)pyrimidine-2,4(1H,3H)-dione
• Molecular Formula: C₇H₆N₂O₂
• Molecular Weight: 150.13
• CAS Registry Number: 680575-04-6
• SMILES: C#CCn1c(=O)cc[nH]c1=O
• InChI: 1S/C7H6N2O2/c1-2-5-9-6(10)3-4-8-7(9)11/h1,3-4H,5H2,(H,8,11)
• InChIKey: TVIZUSXYZGMYJU-UHFFFAOYSA-N

Properties

• Density: 1.276g/cm³ (Cal.)
• Refractive index: 1.542 (Cal.)