ethyl 5-aMino-1-(2-fluorobenzyl)-1H-pyrazole-3-carboxylate
化学名:ethyl 5-aMino-1-(2-fluorobenzyl)-1H-pyrazole-3-carboxylate
CAS番号.256504-39-9
英語名:ethyl 5-aMino-1-(2-fluorobenzyl)-1H-pyrazole-3-carboxylate
CBNumberCB82663872
MFC13H14FN3O2
MW263.27
MOL File256504-39-9.mol
ethyl 5-aMino-1-(2-fluorobenzyl)-1H-pyrazole-3-carboxylate物理性質
| 沸点 | 451.9±40.0 °C(Predicted) |
| 比重(密度) | 1.29±0.1 g/cm3(Predicted) |
| 蒸気圧 | 0Pa at 20℃ |
| 貯蔵温度 | 2-8°C, protect from light |
| 酸解離定数(Pka) | 1.50±0.10(Predicted) |
| 外観 | オフホワイトからイエロー色の固体 |
| InChI | InChI=1S/C13H14FN3O2/c1-2-19-13(18)11-7-12(15)17(16-11)8-9-5-3-4-6-10(9)14/h3-7H,2,8,15H2,1H3 |
| InChIKey | DVWGQBBJLJWPKJ-UHFFFAOYSA-N |
| SMILES | N1(CC2=CC=CC=C2F)C(N)=CC(C(OCC)=O)=N1 |
| LogP | 1.41 at 20℃ and pH7 |
