1-(1,3-Benzodioxol-5-Yl)-4-Methyl-5-(4-Methyl-1-Piperazinyl)-1-Penten-3-One
[CAS# 66596-45-0]

Identification

• Name: 1-(1,3-Benzodioxol-5-Yl)-4-Methyl-5-(4-Methyl-1-Piperazinyl)-1-Penten-3-One
• Synonyms: (E)-1-(1,3-Benzodioxol-5-Yl)-4-Methyl-5-(4-Methyl-1-Piperazinyl)Pent-1-En-3-One; 1-Penten-3-One, 1-(1,3-Benzodioxol-5-Yl)-4-Methyl-5-(4-Methyl-1-Piperazinyl)-; 1-Penten-3-One, 4-Methyl-1-(3,4-Methylenedioxyphenyl)-5-(4-Methyl-1-Piperazinyl)-
• Molecular Formula: C₁₈H₂₄N₂O₃
• Molecular Weight: 316.40
• CAS Registry Number: 66596-45-0
• SMILES: C2=C1OCOC1=CC=C2\C=C\C(C(CN3CCN(CC3)C)C)=O
• InChI: 1S/C18H24N2O3/c1-14(12-20-9-7-19(2)8-10-20)16(21)5-3-15-4-6-17-18(11-15)23-13-22-17/h3-6,11,14H,7-10,12-13H2,1-2H3/b5-3+
• InChIKey: AQNFQYIAWPDOTC-HWKANZROSA-N

Properties

• Density: 1.158g/cm³ (Cal.)
• Boiling point: 471.365°C at 760 mmHg (Cal.)
• Flash point: 238.873°C (Cal.)