2-Acetyl-1,2,4-Triazabicyclo[2.2.2]Octan-3-One
[CAS# 29924-76-3]

Identification

• Name: 2-Acetyl-1,2,4-Triazabicyclo[2.2.2]Octan-3-One
• Synonyms: 2-Acetyl-1,2,4-triazabicyclo[2.2.2]octan-3-one #
• Molecular Formula: C₇H₁₁N₃O₂
• Molecular Weight: 169.18
• CAS Registry Number: 29924-76-3
• SMILES: O=C1N2CCN(N1C(=O)C)CC2
• InChI: 1S/C7H11N3O2/c1-6(11)10-7(12)8-2-4-9(10)5-3-8/h2-5H2,1H3
• InChIKey: IXMCMEFVANSSIZ-UHFFFAOYSA-N

Properties

• Density: 1.396g/cm³ (Cal.)
• Boiling point: 255.663°C at 760 mmHg (Cal.)
• Flash point: 109.277°C (Cal.)
• Refractive index: 1.614 (Cal.)