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  • 3-甲基亚磺酰丙基异硫氰酸酯

    1-isothiocyanato-3-methylsulfinylpropane

化合物简介

Iberin is a natural isothiocyanate found in cruciferous plants. Iberin is know to exhibit anticancer efficacy mediated via induction of cell cycle arrest and apoptosis in human neuroblastoma cells and has strong potential for development as a therapeutic agent against cancer.

基本信息

CAS:505-44-2
中文别名
英文别名:C5H9NOS2;3-Methylsulphinylpropylisothiocyanate;sulfpraphane;METHYLSULFINYLPROPYLISOTHIOCYANATE;Iberin;3-Methylsulfinylpropyl isothiocyanate;
分子式:C5H9NOS2
分子量:163.261
精确质量:163.013
Psa:80.73
Logp:1.7235

编号系统

物化性质

密度:1.21 g/cm3
沸点:362.4ºC at 760 mmHg
闪点:173ºC
折射率:1.577

安全信息

生产方法及用途

合成路线

  • 参考文献

    Moon, Joon-Kwan; Kim, Jun-Ran; Ahn, Young-Joon; Shibamoto, Takayuki Journal of Agricultural and Food Chemistry, 2010 , vol. 58, # 11 p. 6672 - 6677

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13C NMR : Predict


1H NMR : Predict


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