1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone

Basic Information

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CAS Number

866545-96-2

Molecular Formula

C9H7BrN2O

Molecular Weight

239.07 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CC(=O)c1c[nH]c2ncc(Br)cc12

InChI

InChI=1S/C9H7BrN2O/c1-5(13)8-4-12-9-7(8)2-6(10)3-11-9/h2-4H,1H3,(H,11,12)

InChIKey

AYSQNMFURHMHBB-UHFFFAOYSA-N

LogP

2.5279999999999996

Topological Polar Surface Area

45.75 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

222

Synonyms & References

English

1-(5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
1-(5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-ethanone
1-(5-Bromo-7-azaindole)ethanone
Ethanone, 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-
1-{5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-one
1-(5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethan-1-one
3-Acetyl-5-bromo-7-azaindole
AYSQNMFURHMHBB-UHFFFAOYSA-N
3023AH
PB26824
AM804435
AK131337
ST2408583
1-(5-bromo-1H-pyrrolo[2,3-b]pyridine

MDL Number

MFCD12403936

FAQ

What is 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2)?

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone is an organic compound with the CAS number 866545-96-2. It is a derivative of pyrrolo[2,3-b]pyridine with a bromo substituent on the 5-position and an acetyl group attached to the nitrogen atom. This compound is known for its potential applications in pharmaceuticals and research due to its unique chemical structure.

What are the main uses of 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2)?

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2) is primarily used in pharmaceutical research and development, particularly in the synthesis of new compounds for drug discovery. It is also used as an intermediate in the production of other organic compounds and can be employed in academic research for studying the properties of related heterocyclic systems.

Is 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2) safe?

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2) is generally safe when handled with proper precautions. However, it should be used in a well-ventilated area and protective equipment should be worn, including gloves and safety goggles. It is important to avoid contact with skin and eyes, and to store it away from sources of ignition. Ingestion or inhalation should be avoided.

How should 1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2) be stored?

1-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (CAS: 866545-96-2) should be stored in a cool, dry place, away from direct sunlight, and in a tightly sealed container. The storage temperature should be maintained below 25°C to prevent degradation. It should be kept away from heat sources and incompatible materials such as oxidizers or acids. Proper ventilation is essential to prevent the accumulation of flammable gases and vapors.