InChIKey | UAYNGOSBKAVHQG-DWMUTHCRSA-N |
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Inchi | 1S/C25H33NO6S/c1-24(2,3)32-23(28)31-21(22(27)30-17-18-13-9-7-10-14-18)20(19-15-11-8-12-16-19)26-33(29)25(4,5)6/h7-16,20-21,26H,17H2,1-6H3/t20-,21+,33?/m0/s1 |
SMILES | [C@@H](C1C=CC=CC=1)(NS(=O)C(C)(C)C)[C@@H](OC(=O)OC(C)(C)C)C(=O)OCC1C=CC=CC=1 |
LogP | 6.09980 |
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PSA | 110.14000 |
沸点 | 591.0±60.0 °C(Predicted) |
酸度系数(pKa) | 9.70±0.70(Predicted) |
密度 | 1.196±0.06 g/cm3(Predicted) |
精确分子量 | 475.20300 |
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