6-Methyl-1-(3,4-Methylenedioxyphenyl)-1-Hepten-3-One
[CAS# 58344-55-1]

Identification

• Name: 6-Methyl-1-(3,4-Methylenedioxyphenyl)-1-Hepten-3-One
• Synonyms: (E)-1-(1,3-Benzodioxol-5-Yl)-6-Methyl-Hept-1-En-3-One; 1-Hepten-3-One, 1-(1,3-Benzodioxol-5-Yl)-6-Methyl- (9Ci); 6-Methyl-1-(3,4-Methylenedioxyphenyl)-1-Hepten-3-One
• Molecular Formula: C₁₅H₁₈O₃
• Molecular Weight: 246.31
• CAS Registry Number: 58344-55-1
• SMILES: C1=C(C=CC2=C1OCO2)\C=C\C(=O)CCC(C)C
• InChI: 1S/C15H18O3/c1-11(2)3-6-13(16)7-4-12-5-8-14-15(9-12)18-10-17-14/h4-5,7-9,11H,3,6,10H2,1-2H3/b7-4+
• InChIKey: IBXZUVNPXSUMCU-QPJJXVBHSA-N

Properties

• Density: 1.111g/cm³ (Cal.)
• Boiling point: 378.403°C at 760 mmHg (Cal.)
• Flash point: 174.096°C (Cal.)