ChemicalBook--->CAS DataBase List--->914349-79-4

914349-79-4

914349-79-4 Structure

914349-79-4 Structure
IdentificationBack Directory
[Name]

(5-BROMOPYRAZIN-2-YL)CARBAMIC ACID TERT-BUTYL ESTER
[CAS]

914349-79-4
[Synonyms]

N-Boc-2-Amino-5-bromopyrazine
2-Bromo-5-(boc-amino)pyrazine
2-Amino-5-bromopyrazine, 2-BOC
tert-Butyl (5-bromopyrazin-2-yl)
2-Amino-5-bromopyrazine, 2-BOC protected
2-Amino-5-bromopyrazine, 2-BOC protected 98%
(5-BROMOPYRAZIN-2-YL)CARBAMIC ACID TERT-BUTYL ESTER
(5-BROMOPYRAZINYL)CARBAMIC ACID 1,1-DIMETHYLETHYL ESTER
CarbaMicacid,(5-broMopyrazinyl)-,1,1-diMethylethylester
tert-Butyl (5-bromopyrazin-2-yl)carbamate, 2-Bromo-5-[(tert-butoxycarbonyl)amino]-1,4-diazine
[Molecular Formula]

C9H12BrN3O2
[MDL Number]

MFCD08275683
[MOL File]

914349-79-4.mol
[Molecular Weight]

274.11
Chemical PropertiesBack Directory
[Boiling point ]

295.2±40.0 °C(Predicted)
[density ]

1.513±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[pka]

10.75±0.70(Predicted)
[InChI]

InChI=1S/C9H12BrN3O2/c1-9(2,3)15-8(14)13-7-5-11-6(10)4-12-7/h4-5H,1-3H3,(H,12,13,14)
[InChIKey]

PNYUSBALYDXDRK-UHFFFAOYSA-N
[SMILES]

C(OC(C)(C)C)(=O)NC1=NC=C(Br)N=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22
[HS Code ]

2933998090
Hazard InformationBack Directory
[Uses]

(5-BROMOPYRAZIN-2-YL) CARBAMIC ACID TERT-BUTYL ESTER can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.
[Synthesis]

Synthesis_914349-79-4
At 0 ??, to 5-bromopyrazine-2-amine (5736.8mg, 32.97mmol) in CH2Cl2 (80mL) solution was added 4-DMAP (403.2mg, 3.30mmol); then at 0 ?? drop two A solution of di-tert-butyl carbonate (11.4ml, 3.30mmol) in CH2Cl2; the mixture was stirred at room temperature; after the completion of the reaction was monitored by TLC, the solution was washed with brine, dried over Na2SO4, filtered, and concentrated in vacuo; the crude product was chromatographed on a silica gel column Method, purified with ethyl acetate/petroleum ether (1/2) to obtain a white solid product (7250.4 mg, yield 80.2%).
Spectrum DetailBack Directory
[Spectrum Detail]

(5-BROMOPYRAZIN-2-YL)CARBAMIC ACID TERT-BUTYL ESTER(914349-79-4)1HNMR
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