2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarbonitrile
[CAS# 79457-91-3]

Identification

• Name: 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarbonitrile
• Synonyms: 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carbonitrile
• Molecular Formula: C₅H₃N₃O₂
• Molecular Weight: 137.10
• CAS Registry Number: 79457-91-3
• SMILES: N#Cc1cc(O)nc(O)n1
• InChI: 1S/C5H3N3O2/c6-2-3-1-4(9)8-5(10)7-3/h1H,(H2,7,8,9,10)
• InChIKey: AEOOOOUAFJLGON-UHFFFAOYSA-N

Properties

• Density: 1.708g/cm³ (Cal.)
• Boiling point: 527.115°C at 760 mmHg (Cal.)
• Flash point: 272.589°C (Cal.)