ChemicalBook--->CAS DataBase List--->757978-33-9

757978-33-9

757978-33-9 Structure

757978-33-9 Structure
IdentificationBack Directory
[Name]

1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-
[CAS]

757978-33-9
[Synonyms]

5-BroMo-3-forMyl-7-azaindole
5-Bromo-7-azaindole-3-carboxaldehyde
5-Bromo-1H-pyrrolo pyridine-3-carbaldehyde
5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxaldehyde
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-
5-bromo-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
[Molecular Formula]

C8H5BrN2O
[MDL Number]

MFCD09755969
[MOL File]

757978-33-9.mol
[Molecular Weight]

225.04
Chemical PropertiesBack Directory
[density ]

1.830±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[pka]

11.42±0.40(Predicted)
[Appearance]

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

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-(757978-33-9)1HNMR
Hazard InformationBack Directory
[Synthesis]

Acetic acid

64-19-7

5-Bromo-7-azaindole

183208-35-7

1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-

757978-33-9

(a) Step 1: Glacial acetic acid (0.2 mL), water (0.4 mL) and hexamethylenetetetramine (0.087 g, 0.62 mmol) were added sequentially to 5-bromo-7-azaindole (0.087 g, 0.44 mmol), and the reaction was carried out in a sealed tube with stirring at 120°C overnight. Upon completion of the reaction, water was added to the mixture and the precipitated solid was collected by filtration to afford 5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde (0.061 g, 62% yield). The product was characterized by 1H NMR (300 MHz, CDCl3): δ 8.46 (d, J = 2.2 Hz, 1H), 8.53 (d, J = 2.2 Hz, 1H), 8.54 (s, 1H), 9.93 (s, 1H).

[References]

[1] Patent: EP2565192, 2013, A1. Location in patent: Paragraph 0304
[2] Patent: US2015/259357, 2015, A1. Location in patent: Paragraph 1561
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