Estimation of acentric factor of organic compounds with corresponding states group contribution method

被引:0
作者
Yi, SZ [1 ]
Jia, YY
Ma, PS
机构
[1] Tianjin Univ Sci & Technol, Mat Sci & Chem Engn Sch, Tianjin 300222, Peoples R China
[2] Tianjin Univ, Sch Chem Engn & Technol, Tianjin 300072, Peoples R China
关键词
acentric factor; estimation of properties; corresponding state group contribution (CSGC); Edmister equation; Reidel equation;
D O I
暂无
中图分类号
TQ [化学工业];
学科分类号
0817 ;
摘要
A new estimation method was proposed by combining the corresponding state principle with the group contribution method through introducing the concept of assumed-critical properties. Combining it with the Reidel equation, a new acentric factor correlation equation (CSGC-Reidel) was developed. Contribution values of 70 groups were obtained by correlating acentric factor data of 228 organic compounds of 14 type substances including saturated hydrocarbons, unsaturated hydrocarbons, cyclanes, aromatics, oxygen compounds, nitrogen compounds, halohydrocarbons, etc. The average error of acentric factor is 3.52% between the literature data and the predicated with the new estimation method.
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页码:709 / 712
页数:4
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