5-aMino-3-(4-phenoxyphenyl)-1H-pyrazole-4-carbonitrile
化学名:5-aMino-3-(4-phenoxyphenyl)-1H-pyrazole-4-carbonitrile
CAS番号.330792-70-6
英語名:5-aMino-3-(4-phenoxyphenyl)-1H-pyrazole-4-carbonitrile
CBNumberCB62604963
MFC16H12N4O
MW276.29
MOL File330792-70-6.mol
5-aMino-3-(4-phenoxyphenyl)-1H-pyrazole-4-carbonitrile物理性質
沸点 | 585.3±50.0 °C(Predicted) |
比重(密度) | 1.37±0.1 g/cm3(Predicted) |
屈折率 | 1.699 |
闪点 | 307.8℃ |
貯蔵温度 | Keep in dark place,Inert atmosphere,Room temperature |
溶解性 | DMSO (Slightly) |
酸解離定数(Pka) | 10.83±0.50(Predicted) |
InChI | InChI=1S/C16H12N4O/c17-10-14-15(19-20-16(14)18)11-6-8-13(9-7-11)21-12-4-2-1-3-5-12/h1-9H,(H3,18,19,20) |
InChIKey | HNIMEQCLCNSCGH-UHFFFAOYSA-N |
SMILES | N1C(C2=CC=C(OC3=CC=CC=C3)C=C2)=C(C#N)C(N)=N1 |
LogP | 3.25298 |