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化合物简介
3-Methyl-2-thiophenecarboxaldehyde is used in the synthesis of 2,3-dimethyl-5-(2,6,10-trimethylundecyl)thiophene. It is also used to investigate versatile bioconversion capacity of baker′s yeast for the generation of thiols from cysteine-aldehyde conjugates.
基本信息
CAS:5834-16-2
中文别名:33-甲基-2-噻吩甲醛;3-甲基噻吩-2-羰醛;3-甲基噻吩-2-甲醛;3-甲基-2-醛基噻吩;3-甲基-2-噻吩甲醛;
英文别名:3-Methyl-2-thiophenecarboxalde;3-METHYLTHIOPHENE-2-FORMALDEHYDE;3-methyl-2-thiophene methanol;3-methylthiophene-2-carbaldehyde;3-METHYLTHIOPHENE-2-ALDEHYDE;3-Methylthiophene-2-carboxaldehyde;3-methyl-2-thiophenecarbaldehyde;2-FORMYL-3-METHYLTHIOPHENE;3-methyl-thiophene-carboxaldehyde;3-METHYL-2-THIENALDEHYDE;3-Methyl-2-Formylthiophene;thiophene,3-Methyl,2-formyl;3-methyl-2-thiophene-carboxaldehyde;
分子式:C6H6OS
分子量:126.176
精确质量:126.014
Psa:45.31
Logp:1.869
中文别名:33-甲基-2-噻吩甲醛;3-甲基噻吩-2-羰醛;3-甲基噻吩-2-甲醛;3-甲基-2-醛基噻吩;3-甲基-2-噻吩甲醛;
英文别名:3-Methyl-2-thiophenecarboxalde;3-METHYLTHIOPHENE-2-FORMALDEHYDE;3-methyl-2-thiophene methanol;3-methylthiophene-2-carbaldehyde;3-METHYLTHIOPHENE-2-ALDEHYDE;3-Methylthiophene-2-carboxaldehyde;3-methyl-2-thiophenecarbaldehyde;2-FORMYL-3-METHYLTHIOPHENE;3-methyl-thiophene-carboxaldehyde;3-METHYL-2-THIENALDEHYDE;3-Methyl-2-Formylthiophene;thiophene,3-Methyl,2-formyl;3-methyl-2-thiophene-carboxaldehyde;
分子式:C6H6OS
分子量:126.176
精确质量:126.014
Psa:45.31
Logp:1.869
编号系统
MDL号:MFCD00005430
物化性质
外观与性状:黄色橙色液体
密度:1.17g/mLat 25°C(lit.)
沸点:78-80 °C (15 mmHg)
闪点:180°F
折射率:n20/D 1.587(lit.)
水溶解性:insoluble
稳定性:Stable under normal temperatures and pressures.
储存条件:Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
密度:1.17g/mLat 25°C(lit.)
沸点:78-80 °C (15 mmHg)
闪点:180°F
折射率:n20/D 1.587(lit.)
水溶解性:insoluble
稳定性:Stable under normal temperatures and pressures.
储存条件:Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
安全信息
安全说明:S23-S24/25-S36/37/39-S26
危险类别码:R36/37/38
WGK Germany:3
海关编码:29349990
危险品标志:Xi
危险类别码:R36/37/38
WGK Germany:3
海关编码:29349990
危险品标志:Xi
生产方法及用途
用途
用作药物中间体
用作药物中间体
合成路线
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参考文献
US2008/21026 A1, ; Page/Page column 17; 28 ; US 20080021026 A1
上游原料
下游产品
图谱
Predict 1H proton NMR
Mass spectrum (electron ionization)












