Indium (III) Tribromide : An Excellent Catalyst for Biginelli Reaction

A highly efficient catalyst indium (III) tribromide is used to synthesize 5-alkoxy- carbonyl-4-hydrocarbyl-3,4-dihydropyrimidin-2(1H)-ones by a three-component coupling of β-keto ester, aldehydes and urea through improved Biginelli reaction.     

A New Convenient Method for the Resolution of 1, 1''''-Binaphthalene-2, 2''''-diol Via a Phosphite Using (-)-Menthol as Resolving Agent

Optically active 1,1-binaphthalene-2, 2-diol has become a quite important chiral source in different fields of chirotechnology, especially in asymmetric synthesis1. Its synthesis and resolution has been extensively studied and various resolution methods have been reported2. Among the reported resolution methods, the following three, namely, via the formation of phosphoric acid derivatives3, boric acid derivatives4 and inclusion complexes5, are the most important. OHOH+_( )-1(-)-(S)-1(+)-(R)…     

Determination of Partial Molar Volumes of EPA and DHA Ethyl Esters in Supercritical Carbon Dioxide

The use of supercritical fluids (SCFs) as solvents has been attracting widespread interest in the research and commercial applications. The study of partial molar volumes of solutes at infinite dilution in the near-critical region is of considerable fundamental importance, as these data reflects the interactions occurring between the solute and the solvent. Experimental measurements of partial molar volumes may be divided into two categories: direct and indirect methods. The direct methods…     

Spacial Structure of Cationic Phosphorus Ligand–Ru (II) Halide Complexes—by DFT Study

The increasing demand to produce enantio-pure pharmaceuticals, flavors, and other fine chemicals has advanced the field of asymmetry catalytic technologies. Among all asymmetry catalytic methods, catalytic enantioselective hydrogenation of unsaturated bonds such as olefins, ketones, and imines, which employs dihydrogen and small amounts of transition-metal complexes modified intrinsically by chiral ligands, is now recognized as being the most promising strategy for the synthesis of large amount…     

The Purification of Glucose Type Glycosyl Nitrate and the Synthesis of Spacer—armed N—Acetyllactosamines and Their Dimers

Our previous paper1,2reported the results of selective synthesis of mannose type glycosides and their dimers in our attempt to synthesize derivatives of N-acetyllacto- samine, which could have potential activity of anti-metastasis3. Further studies on the glycosylation of the accepters exploiting glycosyl nitrate instead of the acetate as donor showed interesting chemoselectivity between the two kinds of donor, namely, the glucose type and the mannose type. The reactivity difference of the t…     

Dioxygen Affinities and Catalytic Oxidation Performance of Cobalt (II)Complexes with N-Aryl Hydroxamic Acid

It is well known that the study on biomimetic oxygen carriers not only has important theoretic significance to discover the mechanism of reversible bonding, activating oxygen as well as the oxidation reaction in organism, but also has potential application in separating oxygen from air and realizing the high efficiency and selectivity of catalytic oxidation reaction under a mild condition1. Metal- porphyrin and metal- phthalol- gaunine have been extensively used as biomimetic oxygen carriers u…     

DiastereoselectiveandEnantioselectiveSynthesisof(1S,2S)-2-Ethyl-1-aminocyclopropaneCarboxylicAcid

During the last decade, 1-aminocyclopropanecarboxylic acid and its derivatives (ACCS) have attracted increasing attention of organic and bioorganic chemists due to their outstanding biological properties, ranging from antimicrobial, insecticidal, plant growth and fruit ripening controls, etc.1. Moreover, the three-membered carbocycle provides building blocks of unprecedented synthetic potential because it undergoes selective ring opening, ring enlargement or cycloaddition reactions2. The mo…     

超临界CO2气爆煤体致裂机理实验研究

为提高超临界CO₂气爆低渗透煤层增透技术的应用水平,进一步研究超临界CO₂气爆煤体致裂机理,利用自主研发的超临界CO₂气爆装置,在多通道电液伺服相似材料试验台上,对原煤和混凝土大试件(1 m×1 m×0.5 m)进行了超临界CO₂气爆实验,用动态应变仪采集试件内部监测点处的变形和破坏信息,并用工业窥镜对爆破孔内裂隙分布进行了观测。分析气爆应力波的变化规律和气爆后试件的破坏形貌特征可知,距离气爆孔由近及远依次分为粉碎区、裂隙区和震动区,其形成机理为:超临界CO₂冲击气爆孔周围介质并形成远超介质抗压强度的球面纵波,介质在径向压应力作用下发生粉碎性破坏,形成粉碎区;应力波传播能量逐步衰减,不足以使介质产生压缩破坏,然而脆性材料抗压不抗拉,其产生的环向应力仍然使介质产生径向裂隙,应力波之后具有准静态加载作用的高压CO₂气体进入裂隙形成气楔,促使裂隙进一步发育和扩展,形成裂隙区;裂隙区以外的介质在低能量应力波的作用下只发生震动,未发生明显破坏,即震动区。裂隙的扩展速度与其到气爆孔距离符合“S”形曲线衰减,裂隙的高速扩展发生在粉碎区,低速扩展发生在裂隙区;距离气爆孔越远,测点的峰值应变越小,相同距离内节理裂隙等结构面越复杂,峰值应变减小的幅度越大且应变波形差别越大。     

多簇压裂干扰应力变化规律及对裂纹扩展的影响

为研究水平井分段多簇压裂缝间的干扰应力及其对裂纹扩展的影响,在现有二维未考虑地应力的单裂缝干扰应力解析解的基础上,利用双平面复变函数保角变换得到了包含地应力项的三维干扰应力解析解。基于扩展有限元法建立三维多裂缝扩展力学模型,利用Python脚本二次开发平台实现了三维多裂缝水力压裂参数化建模,通过解析解与数值计算对比分析,得到如下结论。裂纹两侧裂纹面法向和走向干扰正应力分别为压应力和拉应力,均呈纺锤形,法向干扰应力影响范围大约为走向干扰应力的5倍;裂纹尖端裂纹面法向和走向干扰正应力分别为拉应力和压应力;裂纹尖端两侧存在干扰剪应力;考虑初始地应力对干扰应力解析解进行修正后的干扰应力值均变小;多簇压裂中裂缝间的干扰应力叠加,簇间距越小,叠加效果越强;多簇压裂的干扰应力使裂缝间裂纹面法向压应力增大,走向压应力减小,导致裂纹扩展注水压力升高,裂缝张开的宽度降低,不利于单裂缝的扩展;干扰应力使裂缝间应力差降低,甚至局部最小地应力方向发生改变,有利于形成复杂缝网。     

α-Fe2O3/SiO2纳米颗粒混合体系表面的酸碱性质及其对重金属离子的吸附行为

以Fe(NO₃)₃·9H₂O和正硅酸乙酯(TEOS)为原料, 通过溶胶-凝胶法和辅助模板法分别制备了纳米α-Fe₂O₃和SiO₂, 并对所合成样品进行了粉末X射线衍射(XRD)和BET表征. 使用自动电位滴定仪测定了α-Fe₂O₃/SiO₂纳米颗粒混合体系的表面酸碱性质. 研究了在不同pH下α-Fe₂O₃/SiO₂混合体系对Cu²⁺、Pb²⁺、Zn²⁺离子的吸附行为. 基于上述实验数据, 用WinSGW软件计算了α-Fe₂O₃/SiO₂混合体系表面酸碱配位常数, 并得出结论: α-Fe₂O₃/SiO₂混合体系表面反应为单一脱质子反应≡XOH ⇔ ≡XO^-+ H⁺(lg K = -8.19±0.15), 明显区别于同时具有加质子和脱质子反应的α-Fe₂O₃/SiO₂/γ-Al₂O₃, α-Fe₂O₃/γ-Al₂O₃和SiO₂/γ-Al₂O₃等纳米颗粒混合体系. 在此基础上拟合得到α-Fe₂O₃/SiO₂混合体系吸附重金属离子Cu²⁺、Pb²⁺、Zn²⁺的表面络合反应平衡常数分别为:
≡XOH + M²⁺ ⇔ ≡XOM⁺+ H⁺ [lg K = -3.1, -3.6, -3.8 (M = Cu, Pb, Zn)].
≡XOH＋M²⁺＋H₂O ⇔≡XOMOH＋2H⁺[lg K = -8.8, -8.0, -10.5 (M = Cu, Pb, Zn)]