13 research outputs found
5-Cyano-1,3-phenylene diacetate
In the title molecule, C11H9NO4, the two acetoxy groups are twisted from the plane of the benzene ring by 67.89 (4) and 53.30 (5)°. Both carbonyl groups are on the same side of the aromatic ring. In the crystal, weak C—H...O hydrogen bonds link molecules into layers parallel to the ac plane. The crystal packing exhibits π–π interactions between the aromatic rings, indicated by a short intercentroid distance of 3.767 (3) Å
Recommended from our members
Comments Concerning "A Possible Simplification of the Goss-Modified Abraham Solvation Equation"
This article provides comments concerning "A possible simplification of the Goss-modified Abraham solvation equation," published in Chemosphere in 2013
5-Cyano-1,3-phenylene diacetate
This article discusses 5-cyano-1,3-phenylene diacetate
Recommended from our members
Effect of halogen substitution on the enthalpies of solvation and hydrogen bonding of organic solutes in chlorobenzene and 1,2-dichlorobenzene derived using multi-parameter correlations
Article on the effect of halogen substitution on the enthalpies of solvation and hydrogen bonding of organic solutes in chlorobenzene and 1,2-dichlorobenzene derived using multi-parameter correlations
Comment on “Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata”
This article gives comment to a previous article published in 'Molecular Pharmaceuticals' titled, "Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata.
Recommended from our members
Deduction of physiochemical properties from solubilities: 2,4-dihydroxybenzophenone, biotin, and caprolactam as examples
Article discussing the deduction of physiochemical properties from solubilities and 2,4-dihydroxybenzophenone, biotin, and caprolactam as examples
Effect of halogen substitution on the enthalpies of solvation and hydrogen bonding of organic solutes in chlorobenzene and 1,2-dichlorobenzene derived using multi-parameter correlations
Article on the effect of halogen substitution on the enthalpies of solvation and hydrogen bonding of organic solutes in chlorobenzene and 1,2-dichlorobenzene derived using multi-parameter correlations
Recommended from our members
Comment on "Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata"
This article gives comment to a previous article published in 'Molecular Pharmaceuticals' titled, "Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata.
5-Cyano-1,3-phenylene diacetate
Key indicators: single-crystal X-ray study; T = 200 K; mean (C-C) = 0.002 Å; R factor = 0.031; wR factor = 0.092; data-to-parameter ratio = 15.8. In the title molecule, C 11 H 9 NO 4 , the two acetoxy groups are twisted from the plane of the benzene ring by 67.89 (4) and 53.30 (5) . Both carbonyl groups are on the same side of the aromatic ring. In the crystal, weak C-HÁ Á ÁO hydrogen bonds link molecules into layers parallel to the ac plane. The crystal packing exhibits -interactions between the aromatic rings, indicated by a short intercentroid distance of 3.767 (3) Å . Related literatur