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209959-33-1

209959-33-1 Structure

209959-33-1 Structure
IdentificationBack Directory
[Name]

2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE
[CAS]

209959-33-1
[Synonyms]

N,N-bis-Boc-2-aMino-5-broMopyriMidine
2-(N,N-BisBOC-Amino)-5-bromopyrimidine
2-Amino-5-bromopyrimidine, 2,2-Bis-BOC protected
2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE
(5-Bromopyrimidin-2-yl)bis(tert-butoxycarbonyl)amine
di-tert-butyl (5-bromopyrimidin-2-yl)imidodicarbonate
2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE, 95+%
tert-butyl N-(5-broMopyriMidin-2-yl)-N-[(tert-butoxy)carbonyl]carbaMate
2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE ISO 9001:2015 REACH
Imidodicarbonic acid 2-(5-bromo-2-pyrimidinyl)-1,3-bis(1,1-dimethylethyl) ester
N-(5-bromo-2-pyrimidinyl)-N-[(2-methylpropan-2-yl)oxy-oxomethyl]carbamic acid tert-butyl ester
[Molecular Formula]

C14H20BrN3O4
[MDL Number]

MFCD08275685
[MOL File]

209959-33-1.mol
[Molecular Weight]

374.23
Chemical PropertiesBack Directory
[Boiling point ]

415.2±37.0 °C(Predicted)
[density ]

1.390
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

-2.49±0.10(Predicted)
[Appearance]

white solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

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

P261-P280-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE(209959-33-1)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-Amino-5-bromopyrimidine

7752-82-1

Di-tert-butyl dicarbonate

24424-99-5

2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE

209959-33-1

Step A: 2-Amino-5-bromopyrimidine (2.75 g, 15.8 mmol) and di-tert-butyl dicarbonate (7.58 g, 34.8 mmol) were dissolved in pyridine (30 mL) and the reaction was stirred at 70 °C overnight. After completion of the reaction, the solvent was removed by distillation under reduced pressure. The residue was extracted by partitioning with ethyl acetate (EtOAc) and 1N hydrochloric acid aqueous solution. The aqueous layer was extracted once more with ethyl acetate. The organic phases were combined, dried with anhydrous sodium sulfate (Na2SO4), filtered and concentrated under reduced pressure to give 2-[bis(tert-butoxycarbonyl)amino]-5-bromopyrimidine (5.5 g, 93% yield) as a white solid. Mass spectrometry (MS) analysis showed m/z 398.2 [M + Na]+.

[References]

[1] Patent: WO2013/101974, 2013, A1. Location in patent: Paragraph 00816; 00817
[2] Patent: US9617268, 2017, B2. Location in patent: Page/Page column 371
[3] Patent: WO2010/121164, 2010, A2. Location in patent: Page/Page column 93-94
[4] Patent: WO2017/176812, 2017, A1. Location in patent: Paragraph 0276
[5] Patent: EP946508, 2009, B1. Location in patent: Page/Page column 60
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