4-Bromo-1H-pyrrolo[2,3-c]pyridine

Basic Information

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CAS Number

69872-17-9

Molecular Formula

C7H5BrN2

Molecular Weight

197.04 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

188-189 ºC

Boiling Point

337.6℃ at 760 mmHg

Density

1.770

SMILES

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C1=CNC2=CN=CC(=C21)Br

InChI

InChI=1S/C7H5BrN2/c8-6-3-9-4-7-5(6)1-2-10-7/h1-4,10H

InChIKey

NZUWATDXQMWXMY-UHFFFAOYSA-N

LogP

2.3254

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

129

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4-bromo-1H-pyrrolo[2,3-c]pyridine;4-Bromo-6-azaindole
AKOS007930881
AM20061454
1H-Pyrrolo[2,3-c]pyridine, 4-bromo-
AC-22993
SCHEMBL529739
FT-0658920
A9239
Z1255357182
NZUWATDXQMWXMY-UHFFFAOYSA-N
CS-W019705
PB31599
EN300-155130
DTXSID60500854
SY028295
4-bromo-1H-pyrrolo[2 pound not3-c]pyridine
J-514557
4-bromo-1H-pyrrolo[2,3-c]pyridine
69872-17-9
MFCD11847768
4-Bromo-6-azaindole
FS-3369
4-Bromo-1H-pyrrolo[2,3-c]pyridine
1H-PYRROLO[2,3-C]-PYRIDINE,4-BROMO-
4-Brom-6-azaindol
HIN1636
1H-PYRROLO[2,3-C]-PYRIDINE, 4-BROMO-
PubChem24020
KSC496Q3B
WT1429
RP08977

MDL Number

MFCD11847768

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 4-Bromo-1H-pyrrolo[2,3-c]pyridine (CAS: 69872-17-9)?

4-Bromo-1H-pyrrolo[2,3-c]pyridine is a crystalline solid with a molecular weight of approximately 221.01 g/mol. It has a low solubility in water but is more soluble in organic solvents like DMSO and DMF. This compound is chemically reactive, especially towards nucleophiles, and can undergo substitution reactions. It is also prone to hydrolysis under basic conditions.

How is 4-Bromo-1H-pyrrolo[2,3-c]pyridine (CAS: 69872-17-9) typically synthesized?

4-Bromo-1H-pyrrolo[2,3-c]pyridine can be synthesized through a bromination reaction of 1H-pyrrolo[2,3-c]pyridine using bromine in the presence of a Lewis acid catalyst. The reaction is carried out in a chlorinated solvent, and the yield is typically around 75-80%. The selectivity and purity of the product can be enhanced by using appropriate reaction conditions and purification techniques.

What industries use 4-Bromo-1H-pyrrolo[2,3-c]pyridine (CAS: 69872-17-9)?

4-Bromo-1H-pyrrolo[2,3-c]pyridine is used in pharmaceuticals for the synthesis of certain drug candidates. It is also utilized in the development of sensors and semiconductors due to its unique electronic and structural properties. Additionally, it has potential applications in polymer synthesis as a building block.

What precautions should be taken when handling 4-Bromo-1H-pyrrolo[2,3-c]pyridine (CAS: 69872-17-9)?

When handling 4-Bromo-1H-pyrrolo[2,3-c]pyridine, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated hood to minimize exposure to bromine vapor. If a spill occurs, it should be carefully cleaned up with appropriate absorbent materials, and the area should be properly decontaminated. Always refer to the safety data sheet (SDS) for detailed handling and emergency procedures.