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Evaluation and QSAR Study of Joint Toxicity of Substituted Phenols and Cadmium to Photobacterium pho Evaluation and QSAR Study of Joint Toxicity of Substituted Phenols and Cadmium to Photobacterium pho

Evaluation and QSAR Study of Joint Toxicity of Substituted Phenols and Cadmium to Photobacterium pho

  • 期刊名字:高等學?;瘜W研究
  • 文件大小:
  • 論文作者:SU Li-min,YUAN Xing,MU Chun-fa
  • 作者單位:College of Urban and Environmental Sciences
  • 更新時間:2023-04-18
  • 下載次數(shù):
論文簡介

The single toxicity of cadmium(Cd) or 9 substituted phenols to Phtobacterium phosphoreum was determined,respectively. The results indicate that the single toxicity was related to group variety, group sum and substitutive positions. On the basis of single toxicity, the joint toxicity of Cd and 9 substituted phenols was measured. The result indicates that the joint toxicity was basically a simple addition of the single toxicity of them or close to simple addition of the single toxicity of them. QSAR equations were built from the joint toxicity and molecular structural descriptors of substituted phenols under the different Cd concentrations. It was shown that the joint toxicity under different Cd concentrations was related to the identical descriptors, the logarithm of n-octanol/water partition coefficient(lgP) and the heat of formation(△Hf), with R2=0.855, 0.878 and 0.780, respectively. Good agreement between the predicted and observed values was found with R2=0.837.

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