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化合物简介
4-Methylthiazole-5-carboxylic acid is used as a reagent to synthesize thiazolylimidazolidinone compounds that act as Stearoyl-CoA desaturase-1 (SCD1) inhibitors. These SCD1 inhibitors are used in the treatment of metabolic diseases. 4-Methylthiazole-5-carboxylic acid is also used as a reagent to synthesize 4-Methyl-5-formylthiazole, an important intermediate in the synthesis of Cefditoren pivoxil.
基本信息
CAS:20485-41-0
中文别名:4-甲基-1,3-噻唑-5-羧酸;4-甲基-1H-噻唑-5-羧酸;4-甲基-5-噻唑甲酸;
英文别名:4-methyl-1,3-thiadiazole-5-carboxylic acid;4-Methyl-1H-thiazole-5-carboxylic acid;4-Methyl-thiazol-5-carbonsaeure;4-Methyl-5-thiazolecarboxylic acid;4-Methyl-1,3-thiazole-5-carboxylic acid;4-Methylthiazole-5-carboxylic acid;4-methylthiazole-5-carboxylicacid;5-Thiazolecarboxylic acid, 4-methyl-;4-Methyl-thiazole-5-carboxylic acid;5-Thiazolecarboxylic acid,4-methyl;
分子式:C5H5NO2S
分子量:143.164
精确质量:143.004
Psa:78.43
Logp:1.1497
中文别名:4-甲基-1,3-噻唑-5-羧酸;4-甲基-1H-噻唑-5-羧酸;4-甲基-5-噻唑甲酸;
英文别名:4-methyl-1,3-thiadiazole-5-carboxylic acid;4-Methyl-1H-thiazole-5-carboxylic acid;4-Methyl-thiazol-5-carbonsaeure;4-Methyl-5-thiazolecarboxylic acid;4-Methyl-1,3-thiazole-5-carboxylic acid;4-Methylthiazole-5-carboxylic acid;4-methylthiazole-5-carboxylicacid;5-Thiazolecarboxylic acid, 4-methyl-;4-Methyl-thiazole-5-carboxylic acid;5-Thiazolecarboxylic acid,4-methyl;
分子式:C5H5NO2S
分子量:143.164
精确质量:143.004
Psa:78.43
Logp:1.1497
编号系统
MDL号:MFCD00626872
PubChem号:24882570
PubChem号:24882570
物化性质
外观与性状:白色至淡黄色晶体粉末
密度:1.418 g/cm3
沸点:303.6ºC at 760 mmHg
熔点:287°C (dec.)(lit.)
闪点:137.4ºC
折射率:1.611
稳定性:Stable at normal temperratures and pressures.
储存条件:Keep container tightly closed.
蒸汽压:0.003mmHg at 25°C
密度:1.418 g/cm3
沸点:303.6ºC at 760 mmHg
熔点:287°C (dec.)(lit.)
闪点:137.4ºC
折射率:1.611
稳定性:Stable at normal temperratures and pressures.
储存条件:Keep container tightly closed.
蒸汽压:0.003mmHg at 25°C
安全信息
RTECS号:XJ3680000
安全说明:S37/39-S26
WGK Germany:3
危险类别码:R36/37/38
海关编码:2934100090
危险品标志:Xi
危险标志:GHS07
危险性描述:H317
危险性防范说明:P280
信号词:Warning
安全说明:S37/39-S26
WGK Germany:3
危险类别码:R36/37/38
海关编码:2934100090
危险品标志:Xi
危险标志:GHS07
危险性描述:H317
危险性防范说明:P280
信号词:Warning
生产方法及用途
用途
用作医药中间体
用作医药中间体
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict
