Highly selective propylene dimerization catalyzed by C1‐symmetric zirconocene complexes

A series of ethylene‐bridged C₁‐symmetric ansa‐(3‐R‐indenyl)(fluorenyl) zirconocene complexes ( 1 , 2 , 3 , 4 , 5 , 6 , 7 , 8 , 9 ) incorporating a pendant arene substituent on the 3‐position of indenyl ring have been synthesized. The structure of complex 4 was further confirmed by X‐ray diffraction analysis. When activated with methylaluminoxane, four sterically less encumbered complexes 1 , 2 , 4 and 5 could catalyze the dimerization of propylene in toluene at 100°C to afford 2‐methyl‐1‐pentene with high selectivities up to 95.7–98.4% and moderate activities of 2.00 × 10⁴ to 7.89 × 10⁴ g (mol‐Zr?h)^?1. Copyright © 2014 John Wiley & Sons, Ltd.     

Characterization of In Vivo Metabolites of a Potential Anti-obesity Compound,the 3-Methyl-1H-Purine-2,6-Dione Derivative C-11, Employing Ultra-High Performance Liquid Chromatography Coupled with Quadrupole Time-of-Flight Mass Spectrometry

C-11 (2-((7-Ethyl-3-methyl-8-(4-(2-(methyl(pyridin-2-yl)-amino)-ethoxy)phenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)methyl)benzonitrile-one hydrochloride), which is based on the structure of rosiglitazone, was first synthesized in our laboratory and shown to be a promising anti-obesity drug candidate in our previous pharmacological study. Considering the importance of metabolic fate in vivo in the further development of drug candidates during early drug discovery, it is essential to characterize the metabolism of C-11 in vivo. In this work, a method based on ultra-high performance liquid chromatography combined with quadrupole time-of-flight mass spectrometry (UPLC/Q-TOF-MS) was successfully developed to investigate the in vivo metabolic profile of C-11 in rats. Rat urine, feces, and plasma samples were collected from male Sprague–Dawley rats after intravenous administration of C-11 in a single dose of 30 mg kg⁻¹ body weight. Besides the parent drug, a total of 25 metabolites (including 18 phase I and 7 phase II metabolites) were detected and tentatively identified by comparing their mass spectrometry profiles with those of C-11. This enabled the metabolic pathways of C-11 to be proposed for the first time. Our results revealed that N-depyridinylation, N-demethylation, hydroxylation, glucuronidation, and sulfate conjugation are the predominant metabolic pathways of C-11 in rats. The present study provides systematic information on the metabolism of C-11 in vivo, which should lead to a better understanding of its safety and mechanism of action.

     

Quantum Fisher information and chaos in the Dicke model

We introduce a method of quantum tomography for a continuous variable system in position and momentum space. We consider a single two-level probe interacting with a quantum harmonic oscillator by means of a class of Hamiltonians, linear in position and momentum variables, during a tunable time span. We study two cases: the reconstruction of the wavefunctions of pure states and the direct measurement of the density matrix of mixed states. We show that our method can be applied to several physical systems where high quantum control can be experimentally achieved.     

An efficient and facile synthesis of novel substituted pyrimidine derivatives: 4-amino-5-carbonitrile-2-nitroaminopyrimidine

One-pot, multicomponent reaction for the synthesis of novel substituted pyrimidine derivatives: 4-amino-5-carbonitrile-2-nitroaminopyrimidine from aromatic aldehydes, 1-nitroguanidine, and malononitrile under ethanol is described. Because of containing many active functional groups, such as amino, cyan and nitro, these products are important intermediate of organic synthesis. The advantages of this procedure include the short reaction time, mild reaction conditions, and excellent yields.     

Rapid matching algorithm for hyperspectral image based on norm sifting

We propose a rapid spectral matching method by lowering number of comparisons, processing time can be saved. Firstly, 1-norm is chosen as length measure of spectrum, and with this criterion, a 1-norm database is built. Secondly, a subspace is constructed from the whole reference library by retaining the references with the most similar 1-norm values. Finally, matching operations are performed in the subspace to obtain the match result. Simulations of geological mapping with ASTER spectral library show that the proposed method can significantly reduce processing time and enhance accuracy compared with traditional and dimension reduction methods.     

Intrinsic Crosslinking and Gel-Breaking Rheokinetics of CMHEC/CTAB Systems

The intrinsic rheokinetics of carboxymethyl hydroxyethyl cellulose and cetyltrimethyl ammonium bromide (CMHEC/CTAB) synergistic fracturing fluid in static crosslinking and gel-breaking processes were studied in this work. Microrheological properties including solid–liquid balance (SLB) and elasticity index (EI) during the static crosslinking and gel-breaking processes were obtained. The effects of temperature on the crosslinking process, concentration of gel-breaker (ammonium persulfate), and temperature on the gel-breaking process were investigated. The novel intrinsic crosslinking and gel-breaking rheokinetics equations were established, respectively. The results show that the crosslinking process can be divided into two stages, and the intrinsic crosslinking rheokinetics equation can well describe EI curves during the static crosslinking process at different temperatures. The EI curves during the gel-breaking process can be well described by the intrinsic gel-breaking rheokinetics equation. The parameters for these two rheokinetics equations are well-defined and reasonable.     

A Quantum Watermarking Protocol Based on Bell Dual Basis

This paper presents a Bell-dual-basis-based quantum watermarking protocol composed of three major algorithms: watermark embedding and extracting and the intercepting test. The first two are completed by using the entanglement swapping property of Bell dual basis and the test is accomplished through IBF protocol to guarantee its bottom security. The watermarking protocol is mainly designed for the protection of digital copyright in the existence of classical information. This design finds that the quality of digital contents is not damaged with its zero-watermark attributes when embedding watermarks.