(E)-2,6-Dimethylocta-5,7-Dien-4-One
[CAS# 6752-80-3]

Identification

• Name: (E)-2,6-Dimethylocta-5,7-Dien-4-One
• Synonyms: (5E)-2,6-Dimethylocta-5,7-Dien-4-One; 5,7-Octadien-4-One, 2,6-Dimethyl-, (Z)-; Cis-Tagetone
• Molecular Formula: C₁₀H₁₆O
• Molecular Weight: 152.24
• CAS Registry Number: 6752-80-3 (23985-25-3;3588-18-9)
• EINECS: 229-813-0
• SMILES: C(C(=O)\C=C(C=C)/C)C(C)C
• InChI: 1S/C10H16O/c1-5-9(4)7-10(11)6-8(2)3/h5,7-8H,1,6H2,2-4H3/b9-7+
• InChIKey: RJXKHBTYHGBOKV-VQHVLOKHSA-N

Properties

• Density: 0.848g/cm³ (Cal.)
• Boiling point: 222.885°C at 760 mmHg (Cal.)
• Flash point: 86.26°C (Cal.)