The title compound 1,4-bis(benztriazol-1-ylmethyl)-2,4,5,6-trimethylbenzene crys- tallizes in the monoclinic system, space group Pbca with a = 9.842(5), b = 9.455(5), c = 22.165(12) ?, V = 2062.6(18) ?3, Dc = 1.277 ...The title compound 1,4-bis(benztriazol-1-ylmethyl)-2,4,5,6-trimethylbenzene crys- tallizes in the monoclinic system, space group Pbca with a = 9.842(5), b = 9.455(5), c = 22.165(12) ?, V = 2062.6(18) ?3, Dc = 1.277 g/cm3, Z = 4, C24H24N6, Mr = 396.49, μ(MoKa) = 0.079 mm-1 and F(000) = 840. The structure was refined to R = 0.0662 and wR = 0.1891 for 1163 observed reflections (I > 2σ(I)). The title molecule has trans-conformation about the central phenyl ring. The zigzag-like molecules are connected by face-to-face π…π stacking to form an infinite 2D layer.展开更多
目的对2,4-己二炔-1,6-二乙基脲(KE)发生固相聚合反应时的显色动力学规律进行研究,为其作为商业化时间温度指示剂的应用提供指导。方法通过单因素法,分别从浓度、时间、温度3个方面对2,4-己二炔-1,6-二乙基脲在聚合反应过程中的显色动...目的对2,4-己二炔-1,6-二乙基脲(KE)发生固相聚合反应时的显色动力学规律进行研究,为其作为商业化时间温度指示剂的应用提供指导。方法通过单因素法,分别从浓度、时间、温度3个方面对2,4-己二炔-1,6-二乙基脲在聚合反应过程中的显色动力学规律进行研究,利用分光密度仪对光密度值进行测定,并通过计算求得聚合反应的反应级数及反应活化能。结果随着浓度增大或温度升高,KE聚合反应速率逐渐增大,随加热时间的增长,反应速率先增加后减小,在上述条件下,时间温度指示剂的颜色均不断变深;通过计算得到该聚合反应的反应级数为0.31,活化能为37.09 k J/mol。结论 KE作为一种新型的时间温度指示剂,其视觉响应信号易于识别;通过改变指示剂的浓度,可实现对不同产品剩余货架信息的监测;根据其活化能值,可判断出该时间温度指示剂可指示的产品活化能范围为12~61 k J/mol。展开更多
Reaction of 4,4’-(1,4-phenylene)bis(5-acetyl-6-methyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile) (1) with methyl iodide afforded the 4,4’-(1,4-phenylene)bis(5-acetyl-6-methyl-2-(methylthio)nicotinonitrile) (2). Th...Reaction of 4,4’-(1,4-phenylene)bis(5-acetyl-6-methyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile) (1) with methyl iodide afforded the 4,4’-(1,4-phenylene)bis(5-acetyl-6-methyl-2-(methylthio)nicotinonitrile) (2). The reaction of 2 with hydrazine hydrate followed by diazotization reaction af-forded the 1,1’-(1,4-phenylenebis(3-amino-6-methyl-1H-pyrazolo[3,4-b]pyridine-4,5-diyl))bis(e-than-1-one) (3) and 1,1’-(1,4-phenylenebis(3-(chlorodiazenyl)-6-methyl-1H-pyrazolo[3,4-b]-pyridine-4,5-diyl))bis(ethan-1-one) (4) respectively. On the other hand, reaction of 4 with malononitrile, 2-cyanoethanethioamide, ethyl acetoacetate, acetyl acetone, ethyl benzoylacetate, diethylmalonate, ethyl cyanoacetate and phenacylbromide aiming to build up pyrazolotriazine or pyrazole ring on the ring system of 4. Structures of all newly synthesized heterocyclic compounds in the present study were confirmed by considering the data of IR, 1H NMR, mass spectra as well as that of elemental analyses.展开更多
文摘The title compound 1,4-bis(benztriazol-1-ylmethyl)-2,4,5,6-trimethylbenzene crys- tallizes in the monoclinic system, space group Pbca with a = 9.842(5), b = 9.455(5), c = 22.165(12) ?, V = 2062.6(18) ?3, Dc = 1.277 g/cm3, Z = 4, C24H24N6, Mr = 396.49, μ(MoKa) = 0.079 mm-1 and F(000) = 840. The structure was refined to R = 0.0662 and wR = 0.1891 for 1163 observed reflections (I > 2σ(I)). The title molecule has trans-conformation about the central phenyl ring. The zigzag-like molecules are connected by face-to-face π…π stacking to form an infinite 2D layer.
文摘目的对2,4-己二炔-1,6-二乙基脲(KE)发生固相聚合反应时的显色动力学规律进行研究,为其作为商业化时间温度指示剂的应用提供指导。方法通过单因素法,分别从浓度、时间、温度3个方面对2,4-己二炔-1,6-二乙基脲在聚合反应过程中的显色动力学规律进行研究,利用分光密度仪对光密度值进行测定,并通过计算求得聚合反应的反应级数及反应活化能。结果随着浓度增大或温度升高,KE聚合反应速率逐渐增大,随加热时间的增长,反应速率先增加后减小,在上述条件下,时间温度指示剂的颜色均不断变深;通过计算得到该聚合反应的反应级数为0.31,活化能为37.09 k J/mol。结论 KE作为一种新型的时间温度指示剂,其视觉响应信号易于识别;通过改变指示剂的浓度,可实现对不同产品剩余货架信息的监测;根据其活化能值,可判断出该时间温度指示剂可指示的产品活化能范围为12~61 k J/mol。
文摘Reaction of 4,4’-(1,4-phenylene)bis(5-acetyl-6-methyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile) (1) with methyl iodide afforded the 4,4’-(1,4-phenylene)bis(5-acetyl-6-methyl-2-(methylthio)nicotinonitrile) (2). The reaction of 2 with hydrazine hydrate followed by diazotization reaction af-forded the 1,1’-(1,4-phenylenebis(3-amino-6-methyl-1H-pyrazolo[3,4-b]pyridine-4,5-diyl))bis(e-than-1-one) (3) and 1,1’-(1,4-phenylenebis(3-(chlorodiazenyl)-6-methyl-1H-pyrazolo[3,4-b]-pyridine-4,5-diyl))bis(ethan-1-one) (4) respectively. On the other hand, reaction of 4 with malononitrile, 2-cyanoethanethioamide, ethyl acetoacetate, acetyl acetone, ethyl benzoylacetate, diethylmalonate, ethyl cyanoacetate and phenacylbromide aiming to build up pyrazolotriazine or pyrazole ring on the ring system of 4. Structures of all newly synthesized heterocyclic compounds in the present study were confirmed by considering the data of IR, 1H NMR, mass spectra as well as that of elemental analyses.
