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A pair of E/Z-isomers of 2-phenyl-6,7-dihydrobenzofuran-4(5H)-one O-cyanomethyl oxime,C16H14N2O2,as potential drugs for treating peptic ulcer and other acid-related diseases have been synthesized and characterized by IR,MS and NMR spectra.Meanwhile,the crystal of IIIa was obtained and determined by X-ray single-crystal diffraction.Crystal data: monoclinic system,space group P21 /c,a = 8.423(8),b = 19.596(16),c = 8.770(8),β = 107.750(12)°,V = 1379(2)3,Z = 4,F(000) = 560,Dc = 1.283 g/cm3,μ = 0.086 mm 1,R = 0.0681 and wR = 0.2029 for 14472 independent reflections(Rint = 0.0782) and 2428 observed ones(I 2σ(I)). 相似文献
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Compound 1, N-methyl-N-((2-(p-tolyl)quinolin-4-yl)methyl)aniline (C24H22N2), as a potential drug for the treatment of acid-related diseases has been synthesized via palladium-catalyzed intramolecular hydroarylation. The compound was characterized by MS and NMR spectra. Meanwhile, the crystal of 1 was obtained and determined by X-ray single-crystal diffraction. Crystal data: triclinic system, space group Pī, a = 5.548(5), b = 11.545(10), c = 14.546(12), α = 90.427(15), β = 90.727(14), γ = 101.099(16)°, V = 914.1(13)3, Z = 2, F(000) = 360, Dc = 1.230 g/cm3, μ = 0.072 mm-1, R = 0.0564 and wR = 0.1616 for 9768 independent reflections (Rint = 0.0447) and 3003 observed ones (I > 2σ(I)). 相似文献
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Compound(Z)-2-methyl-5,6-dihydrobenzo[d]thiazol-7(4H)-one O-prop-2-yn-1-yl oxime, C11H12N2 OS, as a synthetic precursor of cytotoxic triazoles has been prepared and characterized by NMR spectra. Meanwhile, the crystal of IV was obtained and determined by X-ray single-crystal diffraction. Crystal data: monoclinic system, space group P21/c, a = 9.725(9), b = 8.068(7), c = 14.452(13)A, β = 98.68(2)°, V = 1120.9(17)A3, Z = 4, F(000) = 464, Dc = 1.305 g/cm3, μ = 0.263 mm-1, R = 0.0457 and w R = 0.1298 for 11511 independent reflections(Rint = 0.0709) and 2289 observed ones(I 2σ(I)). 相似文献
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近年来,共价有机骨架材料(COFs)由于具有非常好的热化学稳定性、高的孔隙率和比表面积以及可控的表面功能化,因而在气体存储、分离以及催化等领域拥有潜在的应用价值.共价三嗪骨架材料(CTFs)是一种特殊的新型共价有机骨架材料,它是采用廉价的芳香腈为原料,在熔融的ZnCl2作用下,通过离子热聚合反应制成.本文选择不同的二溴代芳烃化合物,在无毒的K4[Fe(CN)6]·3H2O和微量Pd(OAc)2的作用下,通过氰基化反应合成相应的二氰基单体,二氰基单体再聚合获得共价三嗪骨架.溴代芳烃氰基化转化为芳香氰基化合物的反应中,我们避免使用有毒的金属氰化物,用廉价无毒的K4[Fe(CN)6]·3H2O来代替,并不作任何处理直接使用.同时,以Pd(OAc)2为催化剂,不采用任何昂贵的配体,避免增加实验成本.我们选择1,4-二溴苯为底物,探索最佳的反应条件,包括催化剂用量、溶剂以及反应时间,以得到最高的转化率和产率,整个反应过程用GC-MS监测.然后,扩展底物有芳香杂环化合物2,6-二溴吡啶和多环芳烃1,4-二溴萘.上述三种溴代芳烃氰基化后分别得到对应的二氰基单体1,4-二氰基苯(DCB),2,6-二氰基吡啶(DCP)和1,4-二氰基萘(DCN).二氰基单体再聚合获得共价三嗪骨架,依次为CTFDCB,CTFDCP和CTFDCN.对三种CTF的氮气吸附性能进行了测试,测得三种聚合物CTFDCB,CTFDCP和CTFDCN的BET比表面积依次为2404,1650和780 m2/g.其中,比表面积最大的CTFDCB拥有最大的微孔体积0.85 m3/g,比表面积最小的CTFDCN的微孔体积也有0.52 m3/g.三种聚合物的孔径分别为0.57,0.45和0.54 nm.三种材料的CO2吸附性能测试结果表明,拥有最高N2吸附量的CTFDCB在25和0°C下CO2吸附量分别仅为148和99 mg/g,而N2吸附量较小的CTFDCP的CO2吸附量反而高达225和154 mg/g,CTFDCN为129和97 mg/g.这表明该类多孔材料的CO2吸附性能不仅与孔体积和比表面积有关,也与材料中氮原子含量有很大关系.与其它CO2吸附材料相比,这三种多孔材料的CO2吸附处于一个较高水平. 相似文献
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碳糖苷因其优异的生理活性及耐水解/酶解特性,在医学和生物学领域的研究中受到越来越多的关注,但合成过程中仍面临着立体选择性的控制等挑战.报道了一种3,4-O-碳酸酯烯糖和硝基化合物在双乙酰丙酮钯和1,4-双(二苯膦)丁烷(DPPB)配体的催化作用下,室温反应得到具有高立体选择性的β-碳糖苷的方法,且已由核磁共振(NMR)、高分辨质谱(HRMS)以及X射线单晶衍射等方法确定目标化合物的结构.该方法具有广泛的底物范围,对含吸电子基或供电子基的硝基烷类化合物都有很好的兼容性,能以高产率得到单一β构型的碳糖苷,为快速构建碳苷化合物库提供了可靠方法. 相似文献
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