合成甲苯_2_4_二氨基甲酸甲酯反应体系的热力学分析.pdfVIP

20051 　　 　　　　　　　 22 　 1 　 　 Jan.2005 CHEMICAL　INDUSTRY　AND　EN INEERIN Vol.22 　No.1 　　:1004-9533(2005)01-0008-06 -2,4- 王桂荣, 赵新强, 王延吉 ( , 300130) :由2, 4-二氨基甲苯与碳酸二甲酯制备甲苯-2, 4-二氨基甲酸甲酯为 一复合反应体系。本文用 基团贡献法计算了该反应体系 反应热、吉布斯自由能变化、化学反应平衡常数。对反应原料中 甲醇 含量对甲苯-2, 4-二氨基甲酸甲酯收率 影响进行了计算。计算数据与文献值及试验结果 比较, 表明计算结果可靠, 对实验室研究及工业生产都有重要 指导意义。 :2, 4-二氨基甲苯;甲苯-2, 4-二氨基甲酸甲酯;平衡常数;热力学分析 :TQ013.2　:A Thermodynamic Analysis of Synthesis of Toluene-2, 4-Dicarbamate WAN ui-rong, ZHAO Xin-qiang, WAN Yan-ji (School of Chemical Engineering and Technology, Hebei University of Technology, Tianjin 300130, China) Abstract:The synthesis of toluene-2, 4-dicarbamate (TDC)from 2, 4-diamino toluene and dimethyl carbonate is a complex reaction system.The reaction heat, ibbs free energy change and equilibrium constant of the reactions are calculated by methods of group contribution.The effect of methanol content in the raw material on theyield of TDC is investigated.The comparison among the estimated data, literature data and experimental data show that the results of estimation are reasonable, and the results are very important for experimental research and scale-up of the process. Key words:2, 4-diamino-toluene;toluene-2, 4-dicarbamate;equilibrium constant;thermodynamic analysis 　　-2, 4-(TDI) , TDA DMC TDC , 。 。 TDI , , TDA DMC TDC : , 。 CH3 O TDI 。 NH Cat