(3S,6S)-3-Isopropyl-6-Methyl-2-Piperazinone
[CAS# 509149-18-2]

Identification

• Name: (3S,6S)-3-Isopropyl-6-Methyl-2-Piperazinone
• Synonyms: (3S,6S)-3-isopropyl-6-methylpiperazin-2-one
• Molecular Formula: C₈H₁₆N₂O
• Molecular Weight: 156.23
• CAS Registry Number: 509149-18-2
• SMILES: O/C1=N/[C@@H](C)CN[C@H]1C(C)C
• InChI: 1S/C8H16N2O/c1-5(2)7-8(11)10-6(3)4-9-7/h5-7,9H,4H2,1-3H3,(H,10,11)/t6-,7-/m0/s1
• InChIKey: MANYTVBDDBVVOI-BQBZGAKWSA-N

Properties

• Density: 1.142g/cm³ (Cal.)
• Boiling point: 264.807°C at 760 mmHg (Cal.)
• Flash point: 113.952°C (Cal.)
• Refractive index: 1.545 (Cal.)

References

• (1): P. Sawatzki, T. Mikeska, K. Sandhoff, M. Nieger and T. Kolter. 6(S)-Methyl-3(S)-(1-methylethyl)piperazin-2-one, Acta Cryst. (2003). E59, o171-o173