5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

Basic Information

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CAS Number

849068-61-7

Molecular Formula

C8H5BrN2O2

Molecular Weight

241.04 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

InChI

InChI=1S/C8H5BrN2O2/c9-4-1-5-6(8(12)13)3-11-7(5)10-2-4/h1-3H,(H,10,11)(H,12,13)

InChIKey

AFVRLQXVTZZPGE-UHFFFAOYSA-N

LogP

2.0236

Topological Polar Surface Area

65.97999999999999 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

224

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 5-bromo-
5-BROMO-7-AZAINDOLE-3-CARBOXYLIC ACID
PubChem15009
AFVRLQXVTZZPGE-UHFFFAOYSA-N
VP11192
PB14782
BC003965
AB0026992
AM20061540
W8763
ST24032910
A841009
068B617
5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

MDL Number

MFCD09965908

Customs Code

2933990090

FAQ

What is 5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7)?

5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7) is an organic compound with a molecular formula of C9H5BrN2O2. It is characterized by its unique pyrrolo[2,3-b]pyridine structure, which makes it a building block for various pharmaceutical and chemical applications. This compound is often used in research for its structural and reactive properties.

What are the main uses of 5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7)?

5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7) is primarily used in the pharmaceutical and chemical industries. It serves as a precursor in the synthesis of other molecules and is explored for its potential in drug development. Additionally, it is utilized in research for its structural and functional properties.

Is 5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7) safe?

5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7) is generally safe when handled with appropriate precautions. Users should avoid skin contact and inhalation. Protective measures include wearing gloves, goggles, and a lab coat. Ensure proper ventilation and store in a cool, dry place away from direct sunlight and flammable materials.

How should 5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7) be stored?

5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (CAS: 849068-61-7) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture and contamination. Ensure that all storage areas are well-ventilated to avoid the risk of inhalation or skin contact. Proper storage conditions are crucial to maintain its stability and reactivity.