![ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate 化学構造式](https://www.chemicalbook.com/CAS2/GIF/536759-91-8.gif)
ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
化学名:ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
CAS番号.536759-91-8
英語名:ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate
CBNumberCB12510065
MFC22H20N4O6
MW436.42
MOL File536759-91-8.mol
ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate物理性質
| 融点 | 190-192°C |
| 沸点 | 658.7±55.0 °C(Predicted) |
| 比重(密度) | 1.40 |
| 蒸気圧 | 0Pa at 25℃ |
| 貯蔵温度 | Sealed in dry,Room Temperature |
| 溶解性 | クロロホルム（微量）、酢酸エチル（微量） |
| 酸解離定数(Pka) | -3.80±0.20(Predicted) |
| 外見 | 個体 |
| 色 | ペールブラウンからライトオレンジ |
| InChI | InChI=1S/C22H20N4O6/c1-3-32-22(28)19-18-12-13-24(14-4-6-16(7-5-14)26(29)30)21(27)20(18)25(23-19)15-8-10-17(31-2)11-9-15/h4-11H,3,12-13H2,1-2H3 |
| InChIKey | RQNAOIQEGPVYTC-UHFFFAOYSA-N |
| SMILES | C1(=O)N(C2=CC=C([N+]([O-])=O)C=C2)CCC2C(C(OCC)=O)=NN(C3=CC=C(OC)C=C3)C1=2 |
| LogP | 3.59 at 23℃ and pH6.57 |
