4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

Basic Information

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CAS Number

744209-63-0

Molecular Formula

C13H9ClN2O2S

Molecular Weight

292.75 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

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C(C=CN=C32)Cl

InChI

InChI=1S/C13H9ClN2O2S/c14-12-6-8-15-13-11(12)7-9-16(13)19(17,18)10-4-2-1-3-5-10/h1-9H

InChIKey

ZWIKJILDMNXRAR-UHFFFAOYSA-N

LogP

2.9267000000000003

Topological Polar Surface Area

51.96 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

417

Synonyms & References

English

GS-5696
4-Chloro-1-(phenylsulfonyl)-7-azaindole
A865899
SCHEMBL414843
MFCD04153750
1-Benzenesulfonyl-4-chloro-7-azaindole
SY060992
1H-PYRROLO[2,3-B]PYRIDINE, 4-CHLORO-1-(PHENYLSULFONYL)-
744209-63-0
DTXSID50407904
SB10420
1-(benzenesulfonyl)-4-chloro-1H-pyrrolo[2,3-b]pyridine
4-CHLORO-1-BENZENESULFONYL-7-AZAINDOLE
1H-Pyrrolo[2,3-b]pyridine,4-chloro-1-(phenylsulfonyl)-
4-CHLORO-1-(PHENYLSULFONYL)-1H-PYRROLO[2,3-B]PYRIDINE
CS-B0529
PB26142
1-(benzenesulfonyl)-4-chloropyrrolo[2,3-b]pyridine
4-Chloro-1-benzenesulfonyl-7-azaindole, AldrichCPR
AKOS022174563
1-Benzenesulfonyl-4-chloro-1H-pyrrolo[2,3-b]pyridine
ZWIKJILDMNXRAR-UHFFFAOYSA-N
AMY7644
J-514874
4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
4-Chloro-1-benzenesulfonyl-7-azaindole
1H-Pyrrolo[2,3-b]pyridine, 4-chloro-1-(phenylsulfonyl)-
1-(benzenesulfonyl)-4-chloro-pyrrolo[2,3-b]pyridine
1-benzenesulfonyl-4-chloro-1H-pyrrolo[2,3-b]pyridine
4-chloro-1-phenylsulfonyl-1H-pyrrolo[2,3-b]pyridine
4-chloro-1-phenylsulfonylpyrrol

MDL Number

MFCD04153750

FAQ

What are the physical and chemical properties of 4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine (CAS: 744209-63-0)?

4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine is a crystalline solid with a molecular weight of approximately 310.18 g/mol. It is slightly soluble in water but soluble in organic solvents like DMSO and DMF. This compound exhibits moderate reactivity, particularly under basic conditions. It is stable under normal storage conditions but should be protected from moisture and heat.

How is 4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine (CAS: 744209-63-0) typically synthesized?

4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine can be synthesized via the reaction of 4-chloropyrrolo[2,3-b]pyridine with phenylsulfonyl chloride in the presence of a base, such as triethylamine. The yield is typically around 70-80%, and the reaction is carried out in an inert solvent like dichloromethane. The reaction is selective and proceeds under mild conditions.

What industries use 4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine (CAS: 744209-63-0)?

4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine is used in the pharmaceutical industry for the synthesis of certain drugs, particularly those targeting receptor pathways. It is also used in the semiconductor industry for its electronic properties and in the polymer industry for its potential as a functional monomer.

What precautions should be taken when handling 4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine (CAS: 744209-63-0)?

When handling 4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine, it is important to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or fume hood to avoid inhalation. In the event of a spill, it should be carefully cleaned up using appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.