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350684-49-0

350684-49-0 Structure

350684-49-0 Structure
IdentificationBack Directory
[Name]

TERT-BUTYL 4-(4-AMINOBENZOYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
[CAS]

350684-49-0
[Synonyms]

tert-Butyl 4-(4-aminobenzoyl)
tert-Butyl 4-(4-aMinobenzoyl)piperazine-1-carboxylate
tert-Butyl 4-(4-aminobenzoyl)tetrahydro-1(2H)-pyrazine
2-[3-Bromo-2-oxo-5-(trifluoromethyl)-1-pyridyl]acetamide
2-[3-Chloro-2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetamide
TERT-BUTYL 4-(4-AMINOBENZOYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
1-Piperazinecarboxylic acid, 4-(4-aMinobenzoyl)-, 1,1-diMethylethyl ester
[Molecular Formula]

C16H23N3O3
[MDL Number]

MFCD06659531
[MOL File]

350684-49-0.mol
[Molecular Weight]

305.37
Chemical PropertiesBack Directory
[Melting point ]

159-160
[Boiling point ]

488.1±40.0 °C(Predicted)
[density ]

1?+-.0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[pka]

3.50±0.10(Predicted)
[Appearance]

White to off-white Solid
Safety DataBack Directory
[Symbol(GHS) ]


GHS02
[Signal word ]

Warning
[Hazard statements ]

H228
[Precautionary statements ]

P403-P501c
[HazardClass ]

IRRITANT
[HS Code ]

2933998090
Spectrum DetailBack Directory
[Spectrum Detail]

TERT-BUTYL 4-(4-AMINOBENZOYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE(350684-49-0)1HNMR
Hazard InformationBack Directory
[Synthesis]

TERT-BUTYL 4-(4-NITROBENZOYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE

509073-62-5

TERT-BUTYL 4-(4-AMINOBENZOYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE

350684-49-0

General procedure for the synthesis of tert-butyl 4-(4-aminobenzoyl)tetrahydro-1(2H)-pyrazinecarboxylate from tert-butyl 4-(4-nitrobenzoyl)piperazine-1-carboxylate: a mixture of tert-butyl 4-(4-nitrobenzoyl)piperazine-1-carboxylate (20 g, 60 mmol) with 10% Pd/C (4 g) in methanol (600 mL) was subjected to hydrogen (1 atm) atmosphere and the reaction was stirred at room temperature for 18 hours. After completion of the reaction, the reaction mixture was filtered through diatomaceous earth and the filtrate was concentrated under reduced pressure to afford 18 g of tert-butyl 4-(4-aminobenzoyl)piperazine-1-carboxylate as a white solid in 100% yield.

[References]

[1] Patent: WO2013/177536, 2013, A2. Location in patent: Paragraph 0260
[2] Patent: CN102464631, 2016, B. Location in patent: Paragraph 0094-0096
[3] Patent: WO2018/98275, 2018, A1. Location in patent: Page/Page column 126
[4] Patent: WO2018/98288, 2018, A1. Location in patent: Page/Page column 154; 155
[5] Patent: WO2008/139161, 2008, A1. Location in patent: Page/Page column 161-162
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