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Progress in Chemistry 2003, Vol. 15 Issue (05): 351- Previous Articles   Next Articles

• Review •

The Progress of QSAR/QSPR for Surfactants

Zhang Xiaoyi**;Zhu Huaiwu;Li Li;Li Ganzuo;Wang Zhengwu   

  1. (Guizhou Normal University, Guizhou 550001, China; Department of Chemistry, Binzhou Teachers College, Binzhou 256604, China; Key Laboratory of Colloid and Interface Chemistry for State Education Ministry, Shangdong University, Jinan 250100, China)
  • Received: Revised: Online: Published:
  • Contact: Zhang Xiaoyi
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The recent progress in QSAR/QSPR studies of surfactants and the applications of various structure descriptors has been reviewed. A quantitative structure-property relationship studie on the critical micelle concentration(cmc) of surfactants and the surface tension with charged partial surface area (CPSA)descriptors has been introduced. The charge distribution in ionic surfactants by quantum-chemical calculation and the structure-property of the colloid, which influences properties of surfactant, has also been introduced. The trend of QSAR/QSPR studies on some other properties of surfactants has been discussed.
Key words: surfactants, QSAR, QSPR

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Abstract

The Progress of QSAR/QSPR for Surfactants