(E)-5-Methylhept-4-Ene-2,3,6-Trione
[CAS# 72939-50-5]

Identification

• Name: (E)-5-Methylhept-4-Ene-2,3,6-Trione
• Synonyms: 4-Heptene-2,3,6-Trione, 5-Methyl-; 5-Methyl-4-Heptene-2,3,6-Trione
• Molecular Formula: C₈H₁₀O₃
• Molecular Weight: 154.17
• CAS Registry Number: 72939-50-5
• SMILES: CC(=O)C(/C)=C/C(=O)C(=O)C
• InChI: 1S/C8H10O3/c1-5(6(2)9)4-8(11)7(3)10/h4H,1-3H3/b5-4+
• InChIKey: QLIQXKXISJNMRN-SNAWJCMRSA-N

Properties

• Density: 1.061g/cm³ (Cal.)
• Boiling point: 252.171°C at 760 mmHg (Cal.)
• Flash point: 100.325°C (Cal.)