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化合物简介
基本信息
CAS:112969-42-3
中文别名:
英文别名:5-Pyrimidinecarbonitrile,4-chloro-2-methyl-6-(methylthio);4-chloro-2-methyl-6-methylmercaptopyrimidine-5-carbonitrile;4-Chloro-5-cyano-2-methyl-6-(methylthio)pyrimidine;4-Chloro-2-Methyl-6-(Methylthio)-5-Pyrimidinecarbonitrile;4-chloro-2-methyl-6-methylthiopyrimidine-5-carbonitrile;
分子式:C7H6ClN3S
分子量:199.661
精确质量:198.997
Psa:74.87
Logp:2.03198
中文别名:
英文别名:5-Pyrimidinecarbonitrile,4-chloro-2-methyl-6-(methylthio);4-chloro-2-methyl-6-methylmercaptopyrimidine-5-carbonitrile;4-Chloro-5-cyano-2-methyl-6-(methylthio)pyrimidine;4-Chloro-2-Methyl-6-(Methylthio)-5-Pyrimidinecarbonitrile;4-chloro-2-methyl-6-methylthiopyrimidine-5-carbonitrile;
分子式:C7H6ClN3S
分子量:199.661
精确质量:198.997
Psa:74.87
Logp:2.03198
编号系统
MDL号:MFCD00067846
物化性质
密度:1.39g/cm3
沸点:336.7ºC at 760mmHg
熔点:105-107ºC
闪点:157.5ºC
折射率:1.599
蒸汽压:0.00011mmHg at 25°C
沸点:336.7ºC at 760mmHg
熔点:105-107ºC
闪点:157.5ºC
折射率:1.599
蒸汽压:0.00011mmHg at 25°C
安全信息
海关编码:2933599090
危险品标志:Xi
危险品标志:Xi
生产方法及用途
合成路线
-
参考文献
Ram, Vishnu J; Haque, Navedul; Nath, Mahendra Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1993 , vol. 32, # 7 p. 754 - 759
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图谱
13C NMR : Predict

1H NMR : Predict
