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52333-42-3

52333-42-3 Structure

52333-42-3 Structure
IdentificationBack Directory
[Name]

7-Bromopyrido[2,3-b]pyrazine
[CAS]

52333-42-3
[Synonyms]

7-BROMOPYRIDO[2,3-B]PYRAZINE
7-bromopyrido[3,2-b]pyrazine
7-Bromopyrido[2,3-b]pyrazine97%
Pyrido[2,3-b]pyrazine, 7-bromo-
7-Bromopyrido[2,3-b]pyrazine ISO 9001:2015 REACH
[Molecular Formula]

C7H4BrN3
[MDL Number]

MFCD01105748
[MOL File]

52333-42-3.mol
[Molecular Weight]

210.03
Chemical PropertiesBack Directory
[Melting point ]

161-166°C
[Boiling point ]

293.9±35.0 °C(Predicted)
[density ]

1.758±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

solid
[pka]

-1.00±0.30(Predicted)
[color ]

Faint brown
[InChI]

1S/C7H4BrN3/c8-5-3-6-7(11-4-5)10-2-1-9-6/h1-4H
[InChIKey]

YEDMUIQRKXNDQI-UHFFFAOYSA-N
[SMILES]

Brc1cnc2nccnc2c1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2933998090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

7-Bromopyrido[2,3-b]pyrazine(52333-42-3)1HNMR
7-Bromopyrido[2,3-b]pyrazine(52333-42-3)FT-IR
Hazard InformationBack Directory
[Synthesis]

2,3-Diamino-5-bromopyridine

38875-53-5

1,2-Ethenediylbis(oxy) (9CI)

131543-46-9

7-Bromopyrido[2,3-b]pyrazine

52333-42-3

7-Bromopyrido[2,3-b]pyrazine was synthesized by reacting 2,3-diamino-5-bromopyridine (2 g, 10.6 mmol) and glyoxal (5 mL, 40% aqueous solution) in ethanol (25 mL). The reaction mixture was allowed to stand for 48 hours and then concentrated in vacuum. The resulting residue was ground with ether and dried over air to afford the target product 7-bromopyrido[2,3-b]pyrazine (2.04 g, 92% yield) as a pinkish brown solid. The structure of the product was confirmed by 1H NMR (d6-DMSO): δ 9.28 (d, 1H), 9.20 (d, 1H), 9.12 (d, 1H), 8.95 (d, 1H). LC-MS (ES+) analysis showed m/z 212 ([M+H]+) and retention time (RT) was 1.98 min.

[References]

[1] Patent: WO2010/52448, 2010, A2. Location in patent: Page/Page column 41-42
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