ChemicalBook--->CAS DataBase List--->91252-54-9

91252-54-9

91252-54-9 Structure

91252-54-9 Structure
IdentificationBack Directory
[Name]

ETHYL 5-TERT-BUTYLISOXAZOLE-3-CARBOXYLATE
[CAS]

91252-54-9
[Synonyms]

-1,2-oxazoL
BUTTPARK 146\06-95
ETHYL 5-TERT-BUTYLISOXAZOLE-3-CARBOXYLATE
ethyl 5-tert-butyl-1,2-oxazole-3-carboxylate
5-tert-Butyl-isoxazole-3-carboxylic acid ethyl ester
3-Isoxazolecarboxylic acid, 5-(1,1-dimethylethyl)-, ethyl ester
[Molecular Formula]

C10H15NO3
[MDL Number]

MFCD00085057
[MOL File]

91252-54-9.mol
[Molecular Weight]

197.23
Chemical PropertiesBack Directory
[Boiling point ]

108-111 °C(Press: 5.5 Torr)
[density ]

1.057±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[pka]

-4.93±0.50(Predicted)
[Appearance]

Colorless to light yellow Liquid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P260-P280-P312
[Hazard Codes ]

Xi
[Hazard Note ]

Irritant
[HS Code ]

2934999090
Spectrum DetailBack Directory
[Spectrum Detail]

ETHYL 5-TERT-BUTYLISOXAZOLE-3-CARBOXYLATE(91252-54-9)1HNMR
ETHYL 5-TERT-BUTYLISOXAZOLE-3-CARBOXYLATE(91252-54-9)FT-IR
Hazard InformationBack Directory
[Synthesis]

2-Hexenoic acid, 2-hydroxy-5,5-dimethyl-4-oxo-, ethyl ester

94122-76-6

ETHYL 5-TERT-BUTYLISOXAZOLE-3-CARBOXYLATE

91252-54-9

General procedure for the synthesis of ethyl 5-tert-butyl-isoxazole-3-carboxylate from the compound (CAS:94122-76-6): tert-butyl alkenone (50) (6.00 g, 30.0 mmol) was dissolved in anhydrous ethanol/THF (1:1, 70 mL) and stirred at room temperature. To this solution was added hydroxylamine hydrochloride (2.29 g, 33.0 mmol) and the resulting mixture was stirred under nitrogen protection for 12 hours. Subsequently, the mixture was transferred to a Soxhlet extractor fitted with molecular sieves and heated to reflux for 2 hours. After completion of the reaction, the mixture was allowed to cool and the solvent was removed by evaporation. Water (100 mL) was added and the mixture was extracted with dichloromethane (2 x 100 mL). The organic phases were combined, dried over anhydrous sodium sulfate and concentrated. The crude product was purified by silica gel column chromatography to afford ethyl 5-tert-butyl-isoxazole-3-carboxylate (54) as a colorless oil (3 g, 51% yield).1H NMR (500 MHz, CDCl3) data for 54: δ 6.37 (s, 1H), 4.43 (q, 2H), 1.41 (t, 3H), 1.37 (s, 9H).

[References]

[1] Patent: US2006/199853, 2006, A1. Location in patent: Page/Page column 45
[2] Patent: US2006/223884, 2006, A1. Location in patent: Page/Page column 57-58
91252-54-9 suppliers list
Company Name: J & K SCIENTIFIC LTD.  
Telephone: 18210857532 18210857532
Website: https://www.jkchemical.com
Company Name: BeiJing Hwrk Chemicals Limted  
Telephone: 0757-86329057 18934348241
Website: www.hwrkchemical.com/
Company Name: Shanghai Aladdin Bio-Chem Technology Co.,LTD  
Telephone: 400-6206333 13167063860
Website: www.aladdin-e.com/
Company Name: Shanghai Witofly Chemical Co.,Ltd  
Telephone:
Website: www.witofly.com
Company Name: Chengdu AstaTech Trading Co., Ltd./AstaTech (Chengdu) Pharma. Co., Ltd.  
Telephone: +86-28-85122536 85324413
Website: www.chemicalbook.com/ShowSupplierProductsList12313/0_EN.htm
Company Name: CEG Chemical Science&Technology Co., Ltd.  
Telephone: Mobile:13665161512
Website: www.cegchemical.com
Company Name: Bide Pharmatech Ltd.  
Telephone: 400-164-7117 18317119277
Website: www.bidepharm.com
Company Name: Shanghai Worldyang Chemical Co.,Ltd.  
Telephone: 021-56795766
Website: www.worldyachem.com
Company Name: Cool Pharm, Ltd  
Telephone: 021-60455363 18019463053
Website: www.coolpharm.com
Company Name: Zhengzhou Guancheng Laboratory equipment Sales  
Telephone: 0371-88888888 qq272369594;2159423853qq
Website: https://www.chemicalbook.com/ShowSupplierProductsList16848/0_EN.htm
Company Name: Zhengzhou Alfachem Co., Ltd.  
Telephone: 0371-53765687 18937137882
Website: https://www.chemicalbook.com/supplier/10084342/
Company Name: Amadis Chemical Company Limited  
Telephone: 571-89925085
Website: http://www.amadischem.com
Company Name: Suzhou Ruichi Pharmaceutical Technology Co., Ltd.  
Telephone: 0512-50152853
Website: www.chemicalbook.com/ShowSupplierProductsList20105/0_EN.htm
Company Name: Hangzhou Molcore Biopharmatech Co.,Ltd  
Telephone: 400-711-5280 86-571-81025280
Website: www.molcore.com
Company Name: Sichuan BoYou Biotechnology Co., Ltd.  
Telephone: 028-65791793 18140026355
Website: https://www.chemicalbook.com/ShowSupplierProductsList20202/0_EN.htm
Company Name: Aikon International Limited  
Telephone: 025-58859352 19370895928
Website: www.aikonchem.com
Company Name: Suzhou Nuoouman Biological Technology Co., Ltd.  
Telephone: 15026866316
Website: http://www.nompharm.com/
Company Name: 3A Chemicals  
Telephone: 400-668-9898
Website: www.3achem.com
Tags:91252-54-9 Related Product Information
517870-22-3 3209-72-1 35166-33-7 3405-77-4 19788-35-3 300-87-8