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化合物简介
4-Ethylguaiacol, often abbreviated to 4-EG, is a phenolic compound with the molecular formula C9H12O2. It is produced along with 4-ethylphenol (4-EP) in wine and beer by the spoilage yeast Brettanomyces. When it is produced by the yeast to concentrations greater than the sensory threshold of >600 µg/L, it can contribute bacon, spice, clove, or smoky aromas to the wine. On their own these characters can be quite attractive in a wine, however as the compound usually occurs with 4-EP whose aromas can be more aggressive, the presence of the compound often signifies a wine fault. The ratio in which 4-EP and 4-EG are present can greatly affected the organoleptic properties of the wine.
基本信息
CAS:2785-89-9
中文别名:2-甲氧基-4-乙基苯酚;4-乙基愈创木酚;升香草精;4-乙基愈疮木酚;
英文别名:Guaiacyl ethane;4-Ethylguaiacol;4-Hydroxy-3-methoxy ethylbenzene;2-methoxy-4-ethyphenol;2-Methoxy-4-ethylphenol;p-Ethylguaiacol;4-ethyl-2-methoxy-phenol;4-ethyl-guaiacol;PHENOL,4-ETHYL-2-METHOXY;Phenol, 4-ethyl-2-methoxy-;4-Ethylguaiacol,natural;Homocresol;
分子式:C9H12O2
分子量:152.19
精确质量:152.084
Psa:29.46
Logp:1.9632
中文别名:2-甲氧基-4-乙基苯酚;4-乙基愈创木酚;升香草精;4-乙基愈疮木酚;
英文别名:Guaiacyl ethane;4-Ethylguaiacol;4-Hydroxy-3-methoxy ethylbenzene;2-methoxy-4-ethyphenol;2-Methoxy-4-ethylphenol;p-Ethylguaiacol;4-ethyl-2-methoxy-phenol;4-ethyl-guaiacol;PHENOL,4-ETHYL-2-METHOXY;Phenol, 4-ethyl-2-methoxy-;4-Ethylguaiacol,natural;Homocresol;
分子式:C9H12O2
分子量:152.19
精确质量:152.084
Psa:29.46
Logp:1.9632
编号系统
EINECS号:220-500-4
物化性质
外观与性状:透明无色至淡黄色液体
密度:1.063g/mLat 25°C(lit.)
沸点:234-236°C(lit.)
熔点:15°C(lit.)
闪点:226°F
折射率:n20/D 1.528(lit.)
蒸汽压:0.0173mmHg at 25°C
密度:1.063g/mLat 25°C(lit.)
沸点:234-236°C(lit.)
熔点:15°C(lit.)
闪点:226°F
折射率:n20/D 1.528(lit.)
蒸汽压:0.0173mmHg at 25°C
安全信息
安全说明:S26-S36-S37/39
危险类别码:R22; R36/37/38
WGK Germany:2
危险品运输编码:2810
海关编码:2932999099
危险类别:6.1(b)
包装等级:III
危险品标志:Xn
危险类别码:R22; R36/37/38
WGK Germany:2
危险品运输编码:2810
海关编码:2932999099
危险类别:6.1(b)
包装等级:III
危险品标志:Xn
生产方法及用途
用途
用作食品添加剂及香料。
用作食品添加剂及香料。
合成路线
上游原料
下游产品
图谱
Predict 1H proton NMR

13C NMR : Predict

1H NMR : Predict

Mass spectrum (electron ionization)
