1-(2,6,6-Trimethyl-4-Oxocyclohex-2-Enyl)Buten-3-Yl Acetate
[CAS# 84551-78-0]

Identification

• Name: 1-(2,6,6-Trimethyl-4-Oxocyclohex-2-Enyl)Buten-3-Yl Acetate
• Synonyms: [(E)-1-Methyl-3-(2,6,6-Trimethyl-4-Oxo-1-Cyclohex-2-Enyl)Prop-2-Enyl] Acetate; Acetic Acid [(E)-1-Methyl-3-(2,6,6-Trimethyl-4-Oxo-1-Cyclohex-2-Enyl)Prop-2-Enyl] Ester; Acetic Acid [(E)-3-(4-Keto-2,6,6-Trimethyl-1-Cyclohex-2-Enyl)-1-Methyl-Prop-2-Enyl] Ester
• Molecular Formula: C₁₅H₂₂O₃
• Molecular Weight: 250.34
• CAS Registry Number: 84551-78-0
• EINECS: 283-169-5
• SMILES: CC1(C(C(=CC(=O)C1)C)/C=C/C(OC(=O)C)C)C
• InChI: 1S/C15H22O3/c1-10-8-13(17)9-15(4,5)14(10)7-6-11(2)18-12(3)16/h6-8,11,14H,9H2,1-5H3/b7-6+
• InChIKey: HTJRTNBBUDUZOP-VOTSOKGWSA-N

Properties

• Density: 1.035g/cm³ (Cal.)
• Boiling point: 338.165°C at 760 mmHg (Cal.)
• Flash point: 144.994°C (Cal.)