1,3,5-Trimethyl-5,6-Dihydro-2(1H)-Pyrazinone 4-Oxide
[CAS# 566155-32-6]

Identification

• Name: 1,3,5-Trimethyl-5,6-Dihydro-2(1H)-Pyrazinone 4-Oxide
• Synonyms: 2,4,6-Trimethyl-5-oxo-2,3,4,5-tetrahydropyrazin-1-ium-1-olate; 2,4,6-trimethyl-5-oxo-2,3,4,5-tetrahydropyrazine 1-oxide
• Molecular Formula: C₇H₁₂N₂O₂
• Molecular Weight: 156.18
• CAS Registry Number: 566155-32-6
• SMILES: CC1CN(C(=O)C(=[N+]1[O-])C)C
• InChI: 1S/C7H12N2O2/c1-5-4-8(3)7(10)6(2)9(5)11/h5H,4H2,1-3H3
• InChIKey: INEYZTIREFOTME-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 256.8±23.0°C at 760 mmHg (Cal.)
• Flash point: 109.1±22.6°C (Cal.)
• Refractive index: 1.515 (Cal.)

References

• (1): Frances Heaney, Julie Fenlon, Patrick McArdle and Desmond Cunningham. a-Keto amides as precursors to heterocycles—generation and cycloaddition reactions of piperazin-5-one nitrones, Org. Biomol. Chem., 2003, 1, 1122.