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化合物简介
4-Bromobenzoic Acid Methyl Ester is halogenated benzoate used as a reagent in organic synthesis. 4-Bromobenzoic Acid Methyl Ester can be used to stimulate microbial dechlorination of PCBs. 4-Bromobenzoic Acid Methyl Ester is also used in the preparation of stable radioiodinating reagent to label monoclonal antibodies for radiotherapy of cancer.
基本信息
CAS:619-42-1
中文别名:甲基-4-溴苯甲酸甲酯;4-溴苯甲酸甲酯;甲基4-溴苯甲酸酯;
英文别名:p-Bromobenzoic acid,methyl ester;F3095-4305;4-Bromobenzoic Acid Methyl Ester;Benzoic acid,4-bromo-,methyl ester;METHYL P-BROMOBENZOATE;methyl 4-bromo-benzoate;p-Br(C6H4)CO2Me;Benzoic acid,p-bromo-,methyl ester;Benzoic acid, 4-bromo-, methyl ester;4-bromo-methylbenzoate;
分子式:C8H7BrO2
分子量:215.044
精确质量:213.963
Psa:26.3
Logp:2.2357
中文别名:甲基-4-溴苯甲酸甲酯;4-溴苯甲酸甲酯;甲基4-溴苯甲酸酯;
英文别名:p-Bromobenzoic acid,methyl ester;F3095-4305;4-Bromobenzoic Acid Methyl Ester;Benzoic acid,4-bromo-,methyl ester;METHYL P-BROMOBENZOATE;methyl 4-bromo-benzoate;p-Br(C6H4)CO2Me;Benzoic acid,p-bromo-,methyl ester;Benzoic acid, 4-bromo-, methyl ester;4-bromo-methylbenzoate;
分子式:C8H7BrO2
分子量:215.044
精确质量:213.963
Psa:26.3
Logp:2.2357
编号系统
MDL号:MFCD00013531
物化性质
外观与性状:白色
密度:1,689 g/cm3
沸点:262.2ºC at 760 mmHg
熔点:77-81°C(lit.)
闪点:112.4ºC
折射率:1.549
稳定性:Stable under normal temperatures and pressures.
储存条件:Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
密度:1,689 g/cm3
沸点:262.2ºC at 760 mmHg
熔点:77-81°C(lit.)
闪点:112.4ºC
折射率:1.549
稳定性:Stable under normal temperatures and pressures.
储存条件:Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
安全信息
安全说明:S26-S24/25
WGK Germany:3
危险类别码:R36/37/38
海关编码:2916399090
危险品标志:Xi
WGK Germany:3
危险类别码:R36/37/38
海关编码:2916399090
危险品标志:Xi
生产方法及用途
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上游原料
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图谱
Predict 1H proton NMR

13C NMR : Predict

1H NMR : Predict

13C NMR : in CDCl3

1H NMR : 90 MHz in CDCl3

Raman : 4880 A,200 M,powder

Mass

IR : KBr disc

IR : CCl4 solution

IR : nujol mull
