Crystal structures of 4-(oxiran-2-ylmethoxy) benzoic acid and 4-acetoxybenzoic acid

Compounds 4-(oxiran-2-ylmethoxy)benzoic acid ( 2 ) and 4-acetoxybenzoic acid ( 4 ) are synthesized by a new synthetic route and studied by X-ray crystallography. Compound 2 crystallizes in the monoclinic system, P 2 1 / n space group, a = 5.1209(2) Å, b = 30.3429(16) Å, c = 5.9153(3) Å, β = 96.725(3...

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Veröffentlicht in:Journal of structural chemistry 2012-07, Vol.53 (4), p.793-799
Hauptverfasser: Obreza, A., Perdih, F.
Format: Artikel
Sprache:eng
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Zusammenfassung:Compounds 4-(oxiran-2-ylmethoxy)benzoic acid ( 2 ) and 4-acetoxybenzoic acid ( 4 ) are synthesized by a new synthetic route and studied by X-ray crystallography. Compound 2 crystallizes in the monoclinic system, P 2 1 / n space group, a = 5.1209(2) Å, b = 30.3429(16) Å, c = 5.9153(3) Å, β = 96.725(3)°, V = 912.81(8) Å 3 , Z = 4. Compound 4 crystallizes in the triclinic system, P -1 space group, a = 7.3400(4) Å, b = 8.0819(3) Å, c = 15.6548(9) Å, α = 85.754(3)°, β = 84.268(2)°, γ = 70.023(3)°, V = 867.63(8) Å 3 , Z = 4. The crystal structure of 2 comprises two crystallographically independent molecules of the compound. In the crystal structures of 2 and 4 , pairs of molecules form carboxyl dimers.
ISSN:0022-4766
1573-8779
DOI:10.1134/S0022476612040257