Chiral Separation of Ketoprofen on a Chirobiotic T Column and Its Chiral Recognition Mechanisms

Purpose

In this study, direct separation of ketoprofen enantiomers was performed on a Chirobiotic T column.

Methods

The effects of the type and amount of the organic modifier, buffer concentration, pH value, temperature and flow rate on retention and selectivity were investigated. Experiments were carried out in the temperature range of 20–40 °C to study the effects of temperature. Thermodynamic parameters were calculated from plots of ln k or ln α versus 1/T. Molecular dynamics simulation was done to investigate interactions between ketoprofen enantiomers and the chiral selector—teicoplanin.

Results

It was observed that pH and flow rate had a large influence on resolution. Baseline separation of ketoprofen enantiomers could be achieved with low amounts of methanol, high temperature and high buffer concentrations.

Conclusions

Results from a thermodynamic study and molecular dynamics simulation show that steric hindrance effect, π–π complexation, hydrogen bonding and electrostatic forces are the main driving forces which cause chiral recognition of ketoprofen enantiomers.

     

Electromagnetic interactions at RHIC and LHC

At LHC energies, the Lorentz factor will be 3400 for Pb+Pb collisions, and the electromagnetic interactions will play important roles. The cross sections for the electromagnetic particle productions are very large and cannot be ignored for the lifetimes of the beams and background. In this article, we are going to study some of the electromagnetic processes at the RHIC and the LHC and show the cross section calculations of the electron-positron pair production with the giant dipole resonance of the ions.     

Richardson extrapolation and defect correction of mixed finite element methods for integro-differential equations in porous media

Asymptotic error expansions in the sense of L ^∞-norm for the Raviart-Thomas mixed finite element approximation by the lowest-order rectangular element associated with a class of parabolic integro-differential equations on a rectangular domain are derived, such that the Richardson extrapolation of two different schemes and an interpolation defect correction can be applied to increase the accuracy of the approximations for both the vector field and the scalar field by the aid of an interpolation postprocessing technique, and the key point in deriving them is the establishment of the error estimates for the mixed regularized Green’s functions with memory terms presented in R. Ewing at al., Int. J. Numer. Anal. Model 2 (2005), 301–328. As a result of all these higher order numerical approximations, they can be used to generate a posteriori error estimators for this mixed finite element approximation. This project was supported in part by the Special Funds for Major State Basic Research Project (2007CB8149), the National Natural Science Foundation of China (10471103 and 10771158), the Social Science Foundation of the Ministry of Education of China (Numerical methods for convertible bonds, 06JA630047), the NSERC, Tianjin Natural Science Foundation (07JCYBJC14300), and Tianjin University of Finance and Economics.     

Potential of Applying the Geometry-Based Rover Slip Prediction Model Learned on the Earth to the Moon

Russian Physics Journal - Wheeled ground robots are widely used in planetary exploration missions, where slip can measure problems during driving and pre-acquisition slips play an important role....     

Experiments on the synthesis of carotenoid glycosides

Isozeaxanthin was treated with trifluoroacetic acid and tetra-O-benzoyl-1-thio-β-d-glucose to afford β,β-carotene-4,4′-bisthioglucoside isomers in good yields. The deprotected compounds are mimetics of naturally occurring thermoxanthins and can show favourable effects against oxidation stress.     

On the Kolmogorov–Feller law for exchangeable random variables

We prove a Kolmogorov–Feller weak law of large numbers for exchangeable sequences, under a second order hypothesis on the truncated mixands.     

基于非等温能量平衡模型的 GTR 二次击穿特性研究

基于非等温能量平衡传输模型,利用 Silvaco-TCAD 全面系统地分析了发射区半宽度(LE)、发射区边缘刻蚀结构以及浮空发射区结构对 NPN 型硅大功率晶体管(GTR)直流正偏二次击穿特性的影响。结果表明：当 LE为 130μm 时,GTR 直流正偏二次击穿临界点电压(VSB)最高。对于 LE为 150 μm 的 GTR,当发射区边缘横向刻蚀距离为10 μm 时,对直流正偏二次击穿的改善效果最好。当浮空发射区与发射区边缘间距减小到 17 μm 时,浮空发射区开始发挥改善直流正偏二次击穿特性的作用。     

Dihydrooxazolones and dihydroimidazolones derived from acylglycines: syntheses,molecular structures and supramolecular assembly

Syntheses and structures are described for some alkylidene‐substituted dihydrooxazolones and dihydroimidazoles derived from simple acylglycines. A second, triclinic, polymorph of 4‐benzylidene‐2‐(4‐methylphenyl)‐1,3‐oxazol‐5(4H)‐one, C₁₇H₁₃NO₂, (I), has been identified and the structure of 2‐methyl‐4‐[(thiophen‐2‐yl)methylidene]‐1,3‐oxazol‐5(4H)‐one, C₉H₇NO₂S, (II), has been rerefined taking into account the orientational disorder of the thienyl group in each of the two independent molecules. The reactions of phenylhydrazine with 2‐phenyl‐4‐[(thiophen‐2‐yl)methylidene]‐1,3‐oxazol‐5(4H)‐one or 2‐(4‐methylphenyl)‐4‐[(thiophen‐2‐yl)methylidene]‐1,3‐oxazol‐5(4H)‐one yield, respectively, 3‐anilino‐2‐phenyl‐5‐[(thiophen‐2‐yl)methylidene]‐3,5‐dihydro‐4H‐imidazol‐4‐one, C₁₀H₁₅N₃OS, (III), and 3‐anilino‐2‐(4‐methylphenyl)‐5‐[(thiophen‐2‐yl)methylidene]‐3,5‐dihydro‐4H‐imidazol‐4‐one, C₂₁H₁₇N₃OS, (IV), which both exhibit orientational disorder in their thienyl groups. The reactions of 2‐phenyl‐4‐[(thiophen‐2‐yl)methylidene]‐1,3‐oxazol‐5(4H)‐one with hydrazine hydrate or with water yield, respectively, N‐[3‐hydrazinyl‐3‐oxo‐1‐(thiophen‐2‐yl)prop‐1‐en‐2‐yl]benzamide and 2‐(benzoylamino)‐3‐(thiophen‐2‐yl)prop‐2‐enoic acid, which in turn react, respectively, with thiophene‐2‐carbaldehyde to form 2‐phenyl‐5‐[(thiophen‐2‐yl)methylidene]‐3‐{[(E)‐(thiophen‐2‐yl)methylidene]amino}‐3,5‐dihydro‐4H‐imidazol‐4‐one, C₁₉H₁₃N₃OS₂, (V), which exhibits orientational disorder in only one of its thienyl groups, and with methanol to give methyl (2Z)‐2‐(benzoylamino)‐3‐(thiophen‐2‐yl)prop‐2‐enoate, C₁₅H₁₃NO₃S, (VI). There are no direction‐specific intermolecular interactions in the crystal structure of the triclinic polymorph of (I), but the molecules of (II) are linked by two independent C—H...O hydrogen bonds to form C₂²(14) chains. Compounds (III) and (IV) both form centrosymmetric R₂²(10) dimers built from N—H...O hydrogen bonds, while compound (V) forms a centrosymmetric R₂²(10) dimer built from C—H...O hydrogen bonds. In the structure of compound (VI), a combination of N—H...O and C—H...π(arene) hydrogen bonds links the molecules into sheets. Comparisons are made with some similar compounds.     

Separation and Identification of Carotenoids in Flowers of Chelidonium majus L. and Inflorescences of Solidago canadensis L.

The current research project aimed at the carotenoid analysis of total extracts of the inflorescences of Canadian goldenrod (Solidago canadensis L.), and the flowers of greater celandine (Chelidonium majus L.). The plant extracts were separated and analyzed by column liquid chromatography (CLC) and LC. Carotenoids were identified on the basis of their UV–Vis spectroscopic properties in different solvents, chemical reactions [5,6-epoxide → 5,8-epoxide (furanoid oxide rearrangement), (E/Z)-isomerization] and by co-chromatography with authentic reference samples. The parallel use of CLC and LC allowed the identification of numerous minor carotenoids in all extracts and fractions.