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化合物简介
基本信息
CAS:2110-78-3
中文别名:甲基2-羟基异丁酸酯;Α-羥異丁酸甲酯;α-羟基异丁酸甲酯;2-羟基-2-甲基丙酸甲酯;
英文别名:Methyl α-hydroxyisobutyrate;methyl 2-hydroxy-2-methyl-propionate;2-Hydroxyisobutyric Acid Methyl Ester;2-Hydroxyisobutyric acid methyl ester;Methyl 2-hydroxy-2-methylpropanoate;Methyl 2-hydroxyisobutyrate;methyl hydroxyisobutyrate;Propanoic acid, 2-hydroxy-2-methyl-, methyl ester;Propanoic acid,2-hydroxy-2-methyl-,methyl ester;2-hydroxy-2-methyl-propionic acid methyl ester;methyl |A-hydroxyisobutyrate;Methyl 2-methyllactate;
分子式:C5H10O3
分子量:118.131
精确质量:118.063
Psa:46.53
Logp:-0.0697
中文别名:甲基2-羟基异丁酸酯;Α-羥異丁酸甲酯;α-羟基异丁酸甲酯;2-羟基-2-甲基丙酸甲酯;
英文别名:Methyl α-hydroxyisobutyrate;methyl 2-hydroxy-2-methyl-propionate;2-Hydroxyisobutyric Acid Methyl Ester;2-Hydroxyisobutyric acid methyl ester;Methyl 2-hydroxy-2-methylpropanoate;Methyl 2-hydroxyisobutyrate;methyl hydroxyisobutyrate;Propanoic acid, 2-hydroxy-2-methyl-, methyl ester;Propanoic acid,2-hydroxy-2-methyl-,methyl ester;2-hydroxy-2-methyl-propionic acid methyl ester;methyl |A-hydroxyisobutyrate;Methyl 2-methyllactate;
分子式:C5H10O3
分子量:118.131
精确质量:118.063
Psa:46.53
Logp:-0.0697
编号系统
BRN号:1746607
EINECS号:218-301-2
PubChem号:24896967
MDL号:MFCD00004457
EINECS号:218-301-2
PubChem号:24896967
MDL号:MFCD00004457
物化性质
外观与性状:无色液体
密度:1.023g/mLat 25°C(lit.)
沸点:137°C(lit.)
闪点:108°F
折射率:n20/D 1.411(lit.)
稳定性:Stable under normal temperatures and pressures.
储存条件:2-8ºC
蒸汽压:3.46mmHg at 25°C
密度:1.023g/mLat 25°C(lit.)
沸点:137°C(lit.)
闪点:108°F
折射率:n20/D 1.411(lit.)
稳定性:Stable under normal temperatures and pressures.
储存条件:2-8ºC
蒸汽压:3.46mmHg at 25°C
安全信息
安全说明:S16
危险类别码:R10
WGK Germany:3
海关编码:2918199090
危险品运输编码:UN 3272 3/PG 3
危险类别:3.2
包装等级:III
危险类别码:R10
WGK Germany:3
海关编码:2918199090
危险品运输编码:UN 3272 3/PG 3
危险类别:3.2
包装等级:III
生产方法及用途
用途
用于医药中间体,有机合成。
用于医药中间体,有机合成。
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict

13C NMR : in CDCl3

1H NMR : parameter in CDCl3

Mass spectrum (electron ionization)

Mass

Raman : 4880 A,200 M,liquid

IR : liquid film
