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化合物简介
基本信息
CAS:2274-42-2
中文别名:(甲磺酰)乙腈;甲磺酰乙腈;
英文别名:methylsulphonylacetonitrile;Cyanomethylsulfonylmethane;2-(Methylsulfonyl)acetonitrile;2-(metylsulfonyl)acetonitrile;2-methylsulfonylacetonitrile;METHYLSULFONYLACETONITRILE;methylsulfonyl-cyanomethane;Mesylacetonitrile;Methylsulfonylacetonitrile;methanesulphonyl-acetonitrile;2-methanesulfonylacetonitrile;2-(methylsulfonyl)ethanenitrile;Methanesulfonylacetonitrile;
分子式:C3H5NO2S
分子量:119.142
精确质量:119.004
Psa:66.31
Logp:0.63538
中文别名:(甲磺酰)乙腈;甲磺酰乙腈;
英文别名:methylsulphonylacetonitrile;Cyanomethylsulfonylmethane;2-(Methylsulfonyl)acetonitrile;2-(metylsulfonyl)acetonitrile;2-methylsulfonylacetonitrile;METHYLSULFONYLACETONITRILE;methylsulfonyl-cyanomethane;Mesylacetonitrile;Methylsulfonylacetonitrile;methanesulphonyl-acetonitrile;2-methanesulfonylacetonitrile;2-(methylsulfonyl)ethanenitrile;Methanesulfonylacetonitrile;
分子式:C3H5NO2S
分子量:119.142
精确质量:119.004
Psa:66.31
Logp:0.63538
编号系统
PubChem号:24851111
BRN号:969929
MDL号:MFCD00014743
EINECS号:218-888-5
BRN号:969929
MDL号:MFCD00014743
EINECS号:218-888-5
物化性质
密度:1.288g/cm3
沸点:360.6ºC at 760mmHg
熔点:81-84°C(lit.)
闪点:171.9ºC
折射率:1.446
蒸汽压:2.2E-05mmHg at 25°C
沸点:360.6ºC at 760mmHg
熔点:81-84°C(lit.)
闪点:171.9ºC
折射率:1.446
蒸汽压:2.2E-05mmHg at 25°C
安全信息
安全说明:S22-S26-S36
危险类别码:R20/21/22
WGK Germany:3
危险品运输编码:UN 3439 6.1/PG 3
海关编码:2926909090
危险类别:6.1
包装等级:III
危险品标志:Xn; T
危险类别码:R20/21/22
WGK Germany:3
危险品运输编码:UN 3439 6.1/PG 3
海关编码:2926909090
危险类别:6.1
包装等级:III
危险品标志:Xn; T
生产方法及用途
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图谱
13C NMR : Predict

1H NMR : Predict

Mass spectrum (electron ionization)
