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tert-Butyl-4-bromobenzoate

tert-Butyl-4-bromobenzoate Structure
tert-Butyl-4-bromobenzoate structure
CAS No.
59247-47-1
Chemical Name:
tert-Butyl-4-bromobenzoate
Synonyms
tert-Butyl p-BroMobenzoate;tert-Butyl-4-bromobenzoate;Tert-butyl 4-bromobenzoate?New;4-Bromobenzoic acid tert-butyl ester;4-BroMobenzoic Acid 1,1-DiMethylethyl Ester;Benzoic acid, 4-broMo-, 1,1-diMethylethyl ester
CBNumber:
CB6774796
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.12
MDL Number:
MFCD00093266
MOL File:
59247-47-1.mol
MSDS File:
SDS
Last updated:2026-09-12 18:54:24
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tert-Butyl-4-bromobenzoate Properties

Boiling point 91-92 °C(Press: 1.2 Torr)
Density 1.331±0.06 g/cm3(Predicted)
storage temp. Keep in dark place,Sealed in dry,Room Temperature
form liquid
color Colourless to light yellow
InChI InChI=1S/C11H13BrO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h4-7H,1-3H3
InChIKey BFJJYXUCGYOXDM-UHFFFAOYSA-N
SMILES C(OC(C)(C)C)(=O)C1=CC=C(Br)C=C1

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
HS Code  2916399090

tert-Butyl-4-bromobenzoate price More Price(52)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
AstaTech 53802 TERT-BUTYL 4-BROMOBENZOATE 97% 59247-47-1 1G $23 2026-04-30 Buy
AstaTech 53802 TERT-BUTYL 4-BROMOBENZOATE 97% 59247-47-1 5G $49 2026-04-30 Buy
AstaTech 53802 TERT-BUTYL 4-BROMOBENZOATE 97% 59247-47-1 25G $84 2026-04-30 Buy
Apolloscientific OR313102 tert-Butyl 4-bromobenzoate >97% 59247-47-1 1g $21 2026-06-04 Buy
Apolloscientific OR313102 tert-Butyl 4-bromobenzoate >97% 59247-47-1 5g $24 2026-06-04 Buy
Product number Packaging Price Buy
53802 1G $23 Buy
53802 5G $49 Buy
53802 25G $84 Buy
OR313102 1g $21 Buy
OR313102 5g $24 Buy

tert-Butyl-4-bromobenzoate Chemical Properties, Uses, Production

Uses

4-bromo substituted benzoic acid derivative, tert-Butyl-4-broMobenzoate can be used as a building block for the synthesis of various biologically active compounds.

Synthesis

Potassium tert-butoxide

865-47-4

4-Bromobenzoyl chloride

586-75-4

TERT-BUTYL-4-BROMOBENZOATE

59247-47-1

At -78 °C, 4-bromobenzoyl chloride (25.08 g, 114 mmol) was dissolved in THF (120 mL) and a THF solution of potassium tert-butanolate (1 M, 120 mL, 120 mmol) was slowly added. The reaction mixture was stirred at -78 °C and gradually warmed to room temperature for 2 hours. After completion of the reaction, the reaction mixture was diluted with ether. The organic phase was washed sequentially with saturated NaHCO3 solution (2×) and brine (1×) and then dried with anhydrous MgSO4. The desiccant was removed by filtration and the filtrate was concentrated under reduced pressure. The crude product was purified by fast column chromatography on silica gel, the eluent being a hexane solution of 5% ethyl acetate to give tert-butyl 4-bromobenzoate (27.96 g, 95% yield) as a colorless oil.1H NMR (600 MHz, CDCl3) δ 7.84 (d, J = 8.5 Hz, 2H), 7.54 (d, J = 8.5 Hz, 2H), 1.59 (s 9H); ESIMS calculated value 257.0 (M + + H), measured value 257.1 (M + + H).

References

[1] RSC Advances, 2016, vol. 6, # 22, p. 18165 - 18177
[2] Journal of Organic Chemistry, 2000, vol. 65, # 17, p. 5428 - 5430
[3] Patent: WO2007/2248, 2007, A2. Location in patent: Page/Page column 72-73
[4] Organic Process Research and Development, 2012, vol. 16, # 11, p. 1832 - 1845
[5] Journal of the American Chemical Society, 2016, vol. 138, # 32, p. 10293 - 10298

tert-Butyl-4-bromobenzoate Preparation Products And Raw materials

Raw materials

Benzamide, 4-bromo-N-(1,1-dimethylethoxy)- 4-Bromobenzoyl chloride Potassium tert-butoxide 4-Bromobenzoic acid 4-Bromobenzyl alcohol
tert-Butanol Di-tert-butyl dicarbonate

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Preparation Products

tert-Butyl 4-aminobenzoate 4,4',4'',4'''-(1,4-phenylenebis(azanetriyl))tetrabenzoic acid

tert-Butyl-4-bromobenzoate Suppliers

Global Suppliers ( 179)
Supplier Tel Email Country ProdList Advantage
Anhui Yongsheng Pharmaceutical Technology Co., Ltd 3307 18017383231 983544897@qq.com China 941 58
Hangzhou Copiore Chemical Co., Ltd. 17300981287 13757145729 sales@copiore.com China 291 58
Haimen Ruiyi Medical Tech Co., LTD 021-54718086 sales5@ruiyitech.com China 271 58
J & K SCIENTIFIC LTD. 18210857532 18210857532 jkinfo@jkchemical.com China 96815 76
Energy Chemical 400-0056266 sales8178@energy-chemical.com China 44850 61
Beijing Ouhe Technology Co., Ltd 13552068683 13522913783 2355560935@qq.com China 11777 60
JinYan Chemicals(ShangHai) Co.,Ltd. 13817811078 sales@jingyan-chemical.com China 9963 60
Accela ChemBio Co.,Ltd. 021-50795510 4000665055 marketing@accelachem.com China 10972 64
Shanghai Longsheng chemical Co.,Ltd. 58099637 13585536065 sales@shlschem.com China 9880 59
Shanghai Hanhong Scientific Co.,Ltd. 021-54306202 13764082696 info@hanhongsci.com China 42917 64
Supplier Advantage
Anhui Yongsheng Pharmaceutical Technology Co., Ltd 58
Hangzhou Copiore Chemical Co., Ltd. 58
Haimen Ruiyi Medical Tech Co., LTD 58
J & K SCIENTIFIC LTD. 76
Energy Chemical 61
Beijing Ouhe Technology Co., Ltd 60
JinYan Chemicals(ShangHai) Co.,Ltd. 60
Accela ChemBio Co.,Ltd. 64
Shanghai Longsheng chemical Co.,Ltd. 59
Shanghai Hanhong Scientific Co.,Ltd. 64

View Latest Price from tert-Butyl-4-bromobenzoate manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
TERT-BUTYL-4-BROMOBENZOATE pictures 2026-09-02 TERT-BUTYL-4-BROMOBENZOATE
59247-47-1
 $6.00-8.00 1kg 99% Henan Fengda Chemical Co., Ltd
TERT-BUTYL-4-BROMOBENZOATE pictures 2026-06-30 TERT-BUTYL-4-BROMOBENZOATE
59247-47-1
 1kg 99% 10000KGS Shaanxi Dideu New Materials Co. Ltd
TERT-BUTYL-4-BROMOBENZOATE pictures 2020-01-03 TERT-BUTYL-4-BROMOBENZOATE
59247-47-1
 $1.00 1KG 99% 100KG Career Henan Chemical Co

tert-Butyl-4-bromobenzoate Spectrum

TERT-BUTYL-4-BROMOBENZOATE(59247-47-1)1HNMR

59247-47-1 (tert-Butyl-4-bromobenzoate) Related Search:

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4-Bromobenzoic acid tert-butyl ester Benzoic acid, 4-broMo-, 1,1-diMethylethyl ester 4-BroMobenzoic Acid 1,1-DiMethylethyl Ester tert-Butyl p-BroMobenzoate Tert-butyl 4-bromobenzoate?New tert-Butyl-4-bromobenzoate 59247-47-1 Aryl Ester Organohalides Aromatics Intermediates & Fine Chemicals Pharmaceuticals