1-Butyl-4-(4-Ethynylphenyl)-3,5,8-Trioxabicyclo[2.2.2]Octane
[CAS# 108614-27-3]

Identification

• Name: 1-Butyl-4-(4-Ethynylphenyl)-3,5,8-Trioxabicyclo[2.2.2]Octane
• Synonyms: 2,6,7-Trioxabicyclo(2.2.2)Octane, 4-Butyl-1-(4-Ethynylphenyl)-; 4-Butyl-1-(4-Ethynylphenyl)-2,6,7-Trioxabicyclo(2.2.2)Octane
• Molecular Formula: C₁₇H₂₀O₃
• Molecular Weight: 272.34
• CAS Registry Number: 108614-27-3
• SMILES: C1=CC(=CC=C1C23OCC(CO2)(CO3)CCCC)C#C
• InChI: 1S/C17H20O3/c1-3-5-10-16-11-18-17(19-12-16,20-13-16)15-8-6-14(4-2)7-9-15/h2,6-9H,3,5,10-13H2,1H3
• InChIKey: YAJGDRQWUSLQAJ-UHFFFAOYSA-N