A dibenzofuran derivative: 2-(pentyloxy)dibenzo[ b,d]furan

IUCrdata. 2018 Sep;3(9):x181306. doi: 10.1107/S2414314618013068.

Abstract

The title compound, C17H18O2, crystallizes in two-dimensional sheets, in which the 2-(pentyloxy)dibenzo[b,d]furan molecules are arranged in a head-to-head and tail-to-tail fashion that enables hydrophobic interactions between fully extended 2-pentoxy chains and π-π stacking between dibenzofuran rings in adjacent rings. Nearest intermolecular π-π stacking contacts are 3.3731 (12) Å. The molecule is nearly planar with an r.m.s. deviation of 0.0803 Å from the mean plane defined by the nineteen non-hydrogen atoms.

Keywords: P450 inhibitor; crystal structure; dibenzofuran; hydrophobic interactions; π-π stacking interactions.