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tert-butyl (R)-3-(hydroxymethyl)hexanoate

CAS No.
1928755-17-2
Chemical Name:
tert-butyl (R)-3-(hydroxymethyl)hexanoate
Synonyms
Buvacitan impurity 2;Brivaracetam Impurity 6;(R)-tert-Butyl 3-(hydroxymethyl)hexanoate;(R)-tert-Butyl 3-(hydroxymethyl)hexanoate (Brivaracetam Impurity);Hexanoic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3R)-
CBNumber:
CB43143999
Molecular Formula:
C11H22O3
Molecular Weight:
202.29
MDL Number:
MOL File:
1928755-17-2.mol
Last updated:2023-10-17 11:41:45

tert-butyl (R)-3-(hydroxymethyl)hexanoate Properties

Boiling point 278.5±23.0 °C(Predicted)
Density 0.956±0.06 g/cm3(Predicted)
pka 14.78±0.10(Predicted)

tert-butyl (R)-3-(hydroxymethyl)hexanoate price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Crysdot CD13019350 (R)-tert-Butyl3-(hydroxymethyl)hexanoate 97% 1928755-17-2 1g $591 2021-12-16 Buy
Product number Packaging Price Buy
CD13019350 1g $591 Buy

tert-butyl (R)-3-(hydroxymethyl)hexanoate Chemical Properties,Uses,Production

Uses

Tert-butyl (R)-3-(hydroxymethyl)hexanoate is employed in the biocatalytic route to the novel antiepileptic drug brivaracetam.

Synthesis

Sodium borohydride was slowly added to pre-cooled tetrahydrofuran at -5-0°C and stirred for 5 min. BF3-etherate (25.6 g) was slowly added to the reaction mixture at -5-0°C and stirred for 15 min at the same temperature. (R)-2-(2-(tert-butoxy)-2-oxoethyl)pentanoic acid (23 g) was added to the reaction mixture and stirred for 3 h. The reaction mixture was slowly quenched with water and raised the temperature of the reaction mixture to 25-30°C. Separated both the aqueous and organic layers and the aqueous layer was extracted with ethyl acetate. Combined the organic layers and washed with aqueous sodium chloride solution. Distilled off solvent completely from the organic layer to get tert-butyl (R)-3-(hydroxymethyl)hexanoate.Yield: 16.2 g.
tert-butyl (R)-3-(hydroxymethyl)hexanoate

tert-butyl (R)-3-(hydroxymethyl)hexanoate Preparation Products And Raw materials

Raw materials

Preparation Products

tert-butyl (R)-3-(hydroxymethyl)hexanoate Suppliers

Global( 33)Suppliers
Supplier Tel Email Country ProdList Advantage
Shanghai Boc Chemical Co., Ltd.
021-34975602; +8618721111801 shangli@bocchem.com China 138 58
Standardpharm Co. Ltd.
86-714-3992388 overseasales1@yongstandards.com United States 14336 58
China National Standard Pharmaceutical Corporation Limited
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Amadis Chemical Company Limited
571-89925085 sales@amadischem.com China 131980 58
Shanghai YuZn Pharm. Technology Co.,Ltd. 15921286451; 15921286451 2010681527@qq.com China 5067 58
ChemStrong Scientific Co.,Ltd 0755-0755-66853366 13670046396 sales@chem-strong.com China 17993 56
Shanghai Kewel Chemical Co., Ltd. 021-64609169 18901607656 greensnown@163.com China 9911 50
BOC Sciences 16314854226 info@bocsci.com United States 9926 65
Shijiazhuang yaoBo Pharmaceutical Co., Ltd. 15633056635 2880679888@qq.com China 2740 58
Shenzhen Botel Biotechnology Co. Ltd. 0755-22202135 13316968096 1979313431@qq.com China 7931 58
Brivaracetam Impurity 6 (R)-tert-Butyl 3-(hydroxymethyl)hexanoate Hexanoic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3R)- (R)-tert-Butyl 3-(hydroxymethyl)hexanoate (Brivaracetam Impurity) Buvacitan impurity 2 1928755-17-2