(2E)-1-(2,6,6-Trimethyl-2-Cyclohexen-1-Yl)-2-Buten-1-One
[CAS# 24720-09-0]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Ketone fragrance >> Decenone
• Name: (2E)-1-(2,6,6-Trimethyl-2-Cyclohexen-1-Yl)-2-Buten-1-One
• Synonyms: 1-(2,6,6-Trimethyl-1-Cyclohex-2-Enyl)But-2-En-1-One; 1-(2,6,6-Trimethyl-2-Cyclohexen-1-Yl)-2-Butenone; 1-(2,6,6-Trimethyl-2-Cyclohexen-1-Yl)-2-Buten-1-One
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 24720-09-0
• EINECS: 246-430-4
• SMILES: CC1(C(C(=CCC1)C)C(=O)\C=C\C)C
• InChI: 1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7-8,12H,6,9H2,1-4H3/b7-5+
• InChIKey: CRIGTVCBMUKRSL-FNORWQNLSA-N

Properties

• Density: 0.898g/cm³ (Cal.)
• Boiling point: 267.126°C at 760 mmHg (Cal.)
• Flash point: 105.731°C (Cal.)