Unknown

Dataset Information

0

Crystal structure of 3-hy-droxy-2-(4-hy-droxy-3-meth-oxy-phenyl-methyl)-5,5-di-methyl-cyclo-hex-2-enone.

ABSTRACT: In the title compound, C16H20O4, a new starting compound for the synthesis of various heterocycles, the partially saturated six-membered ring adopts a sofa conformation. An intra-molecular O-H⋯O hydrogen bond is observed in the guaiacol residue. In the crystal, mol-ecules are assembled into a sheet structure parallel to the ab plane via O-H⋯O hydrogen bonds. The hydrogen-bond pattern is described by an R44(28) graph-set motif. The sheets are further linked by C-H⋯O hydrogen bonds into a three-dimensional network.

SUBMITTER: Stikute A 

PROVIDER: S-EPMC6002819 | biostudies-literature | 2018 Jun

REPOSITORIES: biostudies-literature

Json Xml
altmetric image

Publications

Crystal structure of 3-hy-droxy-2-(4-hy-droxy-3-meth-oxy-phenyl-methyl)-5,5-di-methyl-cyclo-hex-2-enone.

Stikute Agnese A   Skestere Karina K   Mierina Inese I   Mishnev Anatoly A   Jure Mara M  

Acta crystallographica. Section E, Crystallographic communications 20180515 Pt 6

In the title compound, C<sub>16</sub>H<sub>20</sub>O<sub>4</sub>, a new starting compound for the synthesis of various heterocycles, the partially saturated six-membered ring adopts a sofa conformation. An intra-molecular O-H⋯O hydrogen bond is observed in the guaiacol residue. In the crystal, mol-ecules are assembled into a sheet structure parallel to the <i>ab</i> plane <i>via</i> O-H⋯O hydrogen bonds. The hydrogen-bond pattern is described by an <i>R</i><sub>4</sub><sup>4</sup>(28) graph-set  ...[more]

Similar Datasets

Unknown 3-[(1-Hy-droxy-1-phenyl-propan-2-yl)amino]-5,5-dimethyl-cyclo-hex-2-enone.
| S-EPMC3344556 | biostudies-literature
Unknown 5,5-Bis(hydroxy-meth-yl)-3-methyl-cyclo-hex-2-enone.
| S-EPMC2960602 | biostudies-literature
Unknown 3-[(E)-2-(2-Meth-oxy-phen-yl)vin-yl]-5,5-di-methyl-cyclo-hex-2-enone.
| S-EPMC4011279 | biostudies-literature
Unknown 2,2'-[(3-Bromo-4-hy-droxy-5-meth-oxy-phen-yl)methyl-idene]bis-(3-hy-droxy-5,5-dimethyl-cyclo-hex-2-en-1-one).
| S-EPMC3470230 | biostudies-literature
Unknown 3-Anilino-5,5-di-methyl-cyclo-hex-2-enone.
| S-EPMC3998468 | biostudies-literature
Unknown 3-Hy-droxy-2-[(4-hy-droxy-3,5-dimeth-oxy-phen-yl)(2-hy-droxy-4,4-dimethyl-6-oxo-cyclo-hex-1-en-1-yl)meth-yl]-5,5-dimethyl-cyclo-hex-2-en-1-one.
| S-EPMC3051563 | biostudies-literature
Unknown 3-[(1-Bromo-naphthalen-2-yl)meth-oxy]-5,5-di-methyl-cyclo-hex-2-enone.
| S-EPMC3648284 | biostudies-other
Unknown 2-[Hy-droxy(2-meth-oxy-phenyl)methyl]acrylonitrile.
| S-EPMC3414923 | biostudies-literature
Unknown (4S,5S,6S)-4-Hy-droxy-3-meth-oxy-5-methyl-5,6-ep-oxy-cyclo-hex-2-en-1-one.
| S-EPMC3008014 | biostudies-literature
Unknown 2,2'-[(4-Eth-oxy-phen-yl)methyl-ene]bis-(3-hy-droxy-5,5-dimethyl-cyclo-hex-2-en-1-one).
| S-EPMC3435667 | biostudies-literature