| Prediction of aqueous solubility of PCBs based on molecular structure |
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| 作者姓名： | Huang Guolan Song Rengao Dai Shugui |
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| 作者单位： | Huang Guolan，Song Rengao Dai ShuguiDepartment of Environmental Science，Nankai University，Tianjin 300071，China |
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| 摘 要： | The thermodynamic relationships among aqueous solubility and molar volume (MV) , total molecular surface area (TSA) and molecular connectivity index (MCI) for highly hydrophobic chemicals. PCBs are established and discussed, respectively. Good linear relationships exist among In Cs and MV, TSA or MCI.
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| 关 键 词： | aqueous solubility molar volume total molecular surface area molecular connectivity index. |
| 收稿时间： | 1991/5/22 0:00:00 |
Prediction of aqueous solubility of PCBs based on molecular structure |
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| Huang Guolan,Song Rengao,Dai Shugui.Prediction of aqueous solubility of PCBs based on molecular structure[J].Journal of Environmental Sciences,1993,5(1):30-36. |
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| Authors: | Huang Guolan Song Rengao Dai Shugui |
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| Institution: | Huang Guolan,Song Rengao Dai ShuguiDepartment of Environmental Science,Nankai University,Tianjin 300071,China |
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| Abstract: | The thermodynamic relationships among aqueous solubility and molar volume (MV) , total molecular surface area (TSA) and molecular connectivity index (MCI) for highly hydrophobic chemicals. PCBs are established and discussed, respectively. Good linear relationships exist among In Cs and MV, TSA or MCI. |
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| Keywords: | aqueous solubility molar volume total molecular surface area molecular connectivity index |
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