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文件

348155

Sigma-Aldrich

4-(溴甲基)苯甲酸甲酯

98%

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别名:
α-Bromo-p-toluic acid methyl ester, 4-(Bromomethyl)benzoic acid methyl ester, 4-(Carbomethoxy)benzyl bromide, 4-(Methoxycarbonyl)benzyl bromide, Methyl α-bromo-p-toluate, Methyl p-(bromomethyl)benzoate, p-(Bromomethyl)benzoic acid methyl ester, p-(Carbomethoxy)benzyl bromide, p-(Methoxycarbonyl)benzyl bromide
线性分子式:
BrCH2C6H4CO2CH3
CAS号:
2417-72-3
分子量:
229.07
MDL编号:
MFCD00032453
PubChem化学物质编号:
24861555

检测方案

98%

bp

130-135 °C/2 mmHg (lit.)

mp

57-58 °C (lit.)

SMILES string

COC(=O)c1ccc(CBr)cc1

InChI

1S/C9H9BrO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,6H2,1H3

InChI key

NLWBJPPMPLPZIE-UHFFFAOYSA-N

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相关类别

一般描述

4-(溴甲基)苯甲酸甲酯是一种酯，是一种催泪物质和重要的药物中间体。 酯基在4-(溴甲基)苯甲酸甲酯中略微扭曲出中心芳环的平面。

应用

4-(溴甲基)苯甲酸甲酯可用于合成9-O-(4-羧基苄基)小檗碱（CBB）。

警示用语：

Danger

危险声明

H301 - H314 - H334

危险分类

Acute Tox. 3 Oral - Resp. Sens. 1 - Skin Corr. 1B

储存分类代码

6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

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