CAS 108614-26-2

1-(4-Ethynylphenyl)-4-propyl-2,6,7-trioxabicyclo[2.2.2]octane

Description:

1-(4-Ethynylphenyl)-4-propyl-2,6,7-trioxabicyclo[2.2.2]octane, with CAS number 108614-26-2, is a synthetic organic compound characterized by its unique bicyclic structure, which incorporates three oxygen atoms within its framework. This compound features an ethynyl group attached to a phenyl ring, contributing to its potential reactivity and interaction with other chemical species. The presence of the propyl group enhances its hydrophobic characteristics, influencing its solubility and partitioning behavior in various solvents. The trioxabicyclo structure suggests potential applications in materials science, particularly in the development of polymers or as a building block in organic synthesis. Additionally, the compound may exhibit interesting electronic properties due to the conjugation between the ethynyl and phenyl moieties. Its specific applications and biological activity would depend on further research, including studies on its stability, reactivity, and potential uses in pharmaceuticals or as a functional material in organic electronics.

Formula: C₁₆H₁₈O₃

InChI: InChI=1S/C16H18O3/c1-3-9-15-10-17-16(18-11-15,19-12-15)14-7-5-13(4-2)6-8-14/h2,5-8H,3,9-12H2,1H3

InChI key: InChIKey=HFUCNMPQEAYQDJ-UHFFFAOYSA-N

SMILES: C(CC)C12COC(OC1)(OC2)C3=CC=C(C#C)C=C3

Synonyms:

• 1-(4-Ethynylphenyl)-4-propyl-2,6,7-trioxabicyclo[2.2.2]octane
• 1-(4-Ethynylphenyl)-4-n-propyl-2,6,7-trioxabicyclo[2.2.2]octane
• EBOB
• 2,6,7-Trioxabicyclo[2.2.2]octane, 1-(4-ethynylphenyl)-4-propyl-

1-(4-Ethynylphenyl)-4-propyl-2,6,7-trioxabicyclo[2.2.2]octane

CAS: 108614-26-2

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Formula: C₁₆H₁₈O₃

Purity: Min. 90%

Color and Shape: Powder

Molecular weight: 258.31 g/mol

Ref: 3D-IEA61426