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化合物简介
Methyl Chlorothioformate is a chemical reagent used in the synthesis of Mitomycin C-tethered phosphorothiaoate oligodeoxynucleotides. for use as an anti-tumor antibiotic. Also used in the preparation of Brassinin derivatives, a plant metabolite of great significance due to its dual role both as an effective phytoalexin and as an early biosynthetic precursor of the majority of the phytoalexins.
基本信息
CAS:18369-83-0
中文别名:
英文别名:methyl chlorothiol formate;methylthiolchloroformate;S-methyl carbonochloridothioate;Methyl thiochloroformate;methylthiocarbonyl chloride;s-methylchlorothiolformate;methylchlorothioformate;s-methylchlorothioformate;
分子式:C2H3ClOS
分子量:110.563
精确质量:109.959
Psa:42.37
Logp:1.7082
中文别名:
英文别名:methyl chlorothiol formate;methylthiolchloroformate;S-methyl carbonochloridothioate;Methyl thiochloroformate;methylthiocarbonyl chloride;s-methylchlorothiolformate;methylchlorothioformate;s-methylchlorothioformate;
分子式:C2H3ClOS
分子量:110.563
精确质量:109.959
Psa:42.37
Logp:1.7082
编号系统
PubChem号:24862475
MDL号:MFCD00015516
EINECS号:242-244-2
MDL号:MFCD00015516
EINECS号:242-244-2
物化性质
密度:1.315g/cm3
沸点:107.6ºC at 760mmHg
闪点:31.1ºC
折射率:n20/D 1.49(lit.)
蒸汽压:26.9mmHg at 25°C
沸点:107.6ºC at 760mmHg
闪点:31.1ºC
折射率:n20/D 1.49(lit.)
蒸汽压:26.9mmHg at 25°C
安全信息
安全说明:S16; S26; S27; S36/37/39; S45
危险类别码:R10; R20/21/22; R34
危险品运输编码:UN 2920 8/PG 2
海关编码:2930909090
包装等级:II
危险品标志:C
危险类别码:R10; R20/21/22; R34
危险品运输编码:UN 2920 8/PG 2
海关编码:2930909090
包装等级:II
危险品标志:C
生产方法及用途
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上游原料
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图谱
13C NMR : Predict

1H NMR : Predict

Mass spectrum (electron ionization)
