BENZYL 4-BROMOBUTANOATE

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Products Intro: Product Name:BENZYL 4-BROMOBUTANOATE
CAS:126430-46-4
Purity:98% Package:10MG;50MG;100MG,1G,5G,10G.100G
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CAS:126430-46-4
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Products Intro: Product Name:Benzyl 4-bromobutanoate
CAS:126430-46-4
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Products Intro: Product Name:Benzyl 4-bromobutanoate
CAS:126430-46-4
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Products Intro: Product Name:Benzyl 4-bromobutyrate, technical
CAS:126430-46-4
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BENZYL 4-BROMOBUTANOATE Basic information
Product Name:BENZYL 4-BROMOBUTANOATE
Synonyms:4-broMo-n-butyric acid benzyl ester;4-Bromobutyric acid benzyl ester;4-bromo-n-butyric acid benzyl este;BENZYL 4-BROMOBUTYRATE;BENZYL 4-BROMOBUTANOATE;4-Bromobutanoic acid benzyl ester;Butanoic acid, 4-bromo-, phenylmethyl ester
CAS:126430-46-4
MF:C11H13BrO2
MW:257.12
EINECS:
Product Categories:Acids & Esters;Bromine Compounds
Mol File:126430-46-4.mol
BENZYL 4-BROMOBUTANOATE Structure
BENZYL 4-BROMOBUTANOATE Chemical Properties
Boiling point 314.3±25.0 °C(Predicted)
density 1.364±0.06 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
AppearanceColorless to light yellow Liquid
Safety Information
MSDS Information
BENZYL 4-BROMOBUTANOATE Usage And Synthesis
Synthesis
4-BROMOBUTYRYL CHLORIDE

927-58-2

Benzyl alcohol

100-51-6

BENZYL 4-BROMOBUTANOATE

126430-46-4

GENERAL STEPS: 4-Bromobutanoyl chloride (10.27 g, 55.4 mmol) was dissolved in 100 mL of dichloromethane, followed by the addition of benzyl alcohol (6.29 g, 58.1 mmol). Potassium carbonate (8.3 g, 60 mmol) was added to the reaction mixture in four batches. After 2 hours of reaction, water was added for layering. The organic layer was washed sequentially with water and brine and dried with anhydrous magnesium sulfate. The solvent was removed by evaporation under reduced pressure to give benzyl 4-bromo n-butyrate (11.87 g, 83% yield) as a colorless oil. Its 1H NMR (400 MHz, CDCl3) data were as follows: δ 7.36 (m, 5H), 5.14 (s, 2H), 3.46 (t, J = 6.4 Hz, 2H), 2.56 (t, J = 7.2 Hz, 2H), 2.20 (quin, J = 6.6 Hz, 2H).

References[1] Patent: US2006/189603, 2006, A1. Location in patent: Page/Page column 57
[2] Patent: WO2016/86026, 2016, A1. Location in patent: Paragraph 00140
[3] Journal of Medicinal Chemistry, 1996, vol. 39, # 26, p. 5176 - 5182
[4] Synthesis, 2010, # 6, p. 953 - 958
[5] Patent: EP1724278, 2006, A1. Location in patent: Page/Page column 44-45
BENZYL 4-BROMOBUTANOATE Preparation Products And Raw materials
Raw materials4-Bromobutyric acid-->4-BROMOBUTYRYL CHLORIDE-->Benzyl alcohol-->Dichloromethane-->Potassium carbonate
Tag:BENZYL 4-BROMOBUTANOATE(126430-46-4) Related Product Information
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