erythro-2-(2,6-Dimethoxy-4-methylphenoxy)-1-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,3-diol
Journal article, 2005

In the title compound, C20H26O8, the molecules adopt a conformation in which the torsion angle C(aryl)-C-C-O(aryloxy) is -70.8(2)° and the torsion angle C(aryl)-O-C-C(benzylic) is -152.71(18)°, leading to a C(aryl)...C(aryl) distance of 4.426(3)Å. This distance is identical, within experimental error, to the calculated maximum value obtained when the torsion angle C(aryl)-O-C-C(benzylic) is varied and the torsion angle C(aryl)-C-C-O(aryloxy) is kept constant. The angle between the aromatic ring planes is 64.13(7)°. The conformation is compared with those of related lignin model compounds. The hydrogen-bonding pattern reveals intramolecular interactions, and the formation of centrosymmetric dimers and chains of molecules by intermolecular interactions.

X-ray diffraction

conformation

Author

Vratislav Langer

Chalmers, Chemical and Biological Engineering, Environmental Inorganic Chemistry

Knut Lundquist

Chalmers, Chemical and Biological Engineering, Forest Products and Chemical Engineering

Gerhard E. Miksche

Acta Crystallographica Section E: Structure Reports Online

1600-5368 (ISSN)

Vol. E61 4 o1001-o1003

Subject Categories

Chemical Sciences

More information

Created

10/6/2017