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沸点:
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411.4±55.0 °C(Predicted)
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密度:
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1.468±0.06 g/cm3(Predicted)
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酸度系数(pKa):
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9.73±0.60(Predicted)
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InChI:
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InChI=1S/C7H9ClN2O2S/c8-6-3-5(4-9)1-2-7(6)13(10,11)12/h1-3H,4,9H2,(H2,10,11,12)
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InChIKey:
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BVOXHBKEIMEPSD-UHFFFAOYSA-N
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SMILES:
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C1(S(N)(=O)=O)=CC=C(CN)C=C1Cl
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