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化合物简介
Potent, selective inducer of phase II detoxification enzymes with anticarcinogenic properties. Occurs naturally in broccoli. It was found to inhibit chemically induced mammary tumor formation in rats. Antitumor agent.
基本信息
CAS:142825-10-3
中文别名:
英文别名:L-Sulforaphane;1-isothiocyanato-4-[(R)-methylsulfinyl]butane;(R)-1-Isothiocyanato-4-(methylsulfinyl)butane,4-Methylsulfinylbutyl isothiocyanate;4-Methylsulfinylbutyl isothiocyanate;
分子式:C6H11NOS2
分子量:177.288
精确质量:177.028
Psa:80.73
Logp:2.1136
中文别名:
英文别名:L-Sulforaphane;1-isothiocyanato-4-[(R)-methylsulfinyl]butane;(R)-1-Isothiocyanato-4-(methylsulfinyl)butane,4-Methylsulfinylbutyl isothiocyanate;4-Methylsulfinylbutyl isothiocyanate;
分子式:C6H11NOS2
分子量:177.288
精确质量:177.028
Psa:80.73
Logp:2.1136
编号系统
PubChem号:24724618
MDL号:MFCD09039283
MDL号:MFCD09039283
物化性质
外观与性状:透明淡黄色油状
密度:1.17g/cm3
沸点:368.2ºC at 760mmHg
闪点:176.5ºC
折射率:1.567
储存条件:-20ºC
蒸汽压:0mmHg at 25°C
密度:1.17g/cm3
沸点:368.2ºC at 760mmHg
闪点:176.5ºC
折射率:1.567
储存条件:-20ºC
蒸汽压:0mmHg at 25°C
安全信息
安全说明:S22-S23-S24/25
海关编码:2930909090
海关编码:2930909090
生产方法及用途
合成路线
上游原料
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图谱
13C NMR : Predict

1H NMR : Predict
