Crystal structure of 5-(4--but-oxy-phen-yl)-3-(4--octyloxyphen-yl)-4,5-di-hydro-isoxazole.

Acta Crystallogr E Crystallogr Commun

Instituto de Química, Universidade Federal do Rio Grande do Sul - UFRGS, Av. Bento Gonçalves, 9500, 91501 - 970 - Porto Alegre - RS, Brazil.

Published: June 2019

The mol-ecule of the title compound, CHNO, was prepared by [3 + 2] 1,3-dipolar cyclo-addition of 4--octyl-phenyl-nitrile oxide and 4--but-oxy-styrene, the latter compound being a very useful inter-mediate to the synthesis of liquid-crystalline materials. In the mol-ecule, the benzene rings of the -octyloxyphenyl and -but-oxy-phenyl groups form dihedral angles of 2.83 (7) and 85.49 (3)°, respectively, with the mean plane of the isoxazoline ring. In the crystal, mol-ecules are linked by weak C-H⋯O hydrogen inter-actions into chains running parallel to the axis.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC6658943PMC
http://dx.doi.org/10.1107/S2056989019007412DOI Listing

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