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化合物简介

1H-Pyrazole, is a versatile building block, with a vast applications in organic synthesis. The derivatives of Pyrazole are used in medicine, for their analgesic, anti-inflammatory, antipyretic, antiarrhythmic, tranquilizing, muscle relaxing, psychoanaleptic, anticonvulsant, monoamineoxidase inhibiting, antidiabetic and antibacterial activities.

基本信息

CAS:288-13-1
中文别名:邻二氮杂茂;二氮二烯五环;1,2-二氮唑;
英文别名:1H-Pyrazole;1,2-DIAZOL;1H-PYRAZOLE;2-PyrroMonazole;[3,2-c]pyrazole;1,2-Diazole;Pyrrazole;PYRAZOL;1,2-DIAZOLE;1H-Pyrazol;Pyrazole;PYRAZOLE,PURE;
分子式:C3H4N2
分子量:68.0773
精确质量:68.0374
Psa:28.68
Logp:0.4097

编号系统

MDL号:MFCD00005234

物化性质

外观与性状:白色晶体
密度:1.116 g/cm3
沸点:186-188°C(lit.)
熔点:67-70°C(lit.)
闪点:186-188°C
折射率:1.4203 (20ºC)
水溶解性:SOLUBLE
稳定性:Stable under normal temperatures and pressures.
储存条件:Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
蒸汽压:0.887mmHg at 25°C

安全信息

RTECS号:UQ4900000
安全说明:S26-S36/37-S61-S37/39
WGK Germany:1
危险类别码:R22; R36/37/38
危险品运输编码:2811
海关编码:2933199090
危险类别:6.1(b)
包装等级:III
危险品标志:Xn
危险标志:GHS07
危险性防范说明:P261; P305 + P351 + P338
信号词:Warning
危险性描述:H302; H315; H319; H335

生产方法及用途

用途
产品吡唑的衍生物吡唑啉是医药和染料的重要中间体。

合成路线

上游原料

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图谱

Predict 1H proton NMR


13C NMR : Predict


1H NMR : Predict


Mass spectrum (electron ionization)


UV/Visible spectrum


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