InChIKey | TZDUZBKIZDVZKK-JRIORXAOSA-N |
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Inchi | 1S/C21H26N2O4/c1-27-17-4-2-3-14-18(17)12-7-8-23-10-11-5-6-16(24)19(21(25)26)13(11)9-15(23)20(12)22-14/h2-4,11,13,15-16,19,22,24H,5-10H2,1H3,(H,25,26)/t11-,13+,15+,16-,19+/m1/s1 |
SMILES | [C@H]1(O)[C@@H](C(O)=O)[C@]2(C[C@@]3(N(C[C@]2(CC1)[H])CCC1C2=C(NC3=1)C=CC=C2OC)[H])[H] |
PSA | 52.54 |
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沸点 | 625.7±55.0 °C(Predicted) |
熔点 | 252 °C (decomp) |
酸度系数(pKa) | 4.18±0.40(Predicted) |
密度 | 1.39±0.1 g/cm3(Predicted) |
精确分子量 | 272.08309 |
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