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沸点:
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423.5±45.0 °C(Predicted)
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密度:
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1.124±0.06 g/cm3(Predicted)
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酸度系数(pKa):
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6.72±0.10(Predicted)
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InChI:
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InChI=1S/C16H25N3O2/c1-12-5-6-14(17-11-12)18-13-7-9-19(10-8-13)15(20)21-16(2,3)4/h5-6,11,13H,7-10H2,1-4H3,(H,17,18)
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InChIKey:
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FXGQBINUNSSEGC-UHFFFAOYSA-N
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SMILES:
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N1(C(OC(C)(C)C)=O)CCC(NC2=NC=C(C)C=C2)CC1
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