5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine

Basic Information

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CAS Number

875639-15-9

Molecular Formula

C14H10BrIN2O2S

Molecular Weight

477.12 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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

558.6°C at 760 mmHg

Density

Flash Point

291.6°C

Refractive Index

1.743

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)N1C=C(I)C2=C1N=CC(Br)=C2

InChI

InChI=1S/C14H10BrIN2O2S/c1-9-2-4-11(5-3-9)21(19,20)18-8-13(16)12-6-10(15)7-17-14(12)18/h2-8H,1H3

InChIKey

RNPRNNYUHMYADJ-UHFFFAOYSA-N

LogP

3.948820000000002

Topological Polar Surface Area

51.96 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

476

Synonyms & References

English

1H-Pyrrolo[2,3-b]pyridine,5-bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-
5-bromo-3-iodo-1-tosyl-1H-pyrrolo[2,3-b]pyridine
5-bromo-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine
1H-Pyrrolo[2,3-b]pyridine,5-bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]
5-bromo-3-iodo-1-(p-tolylsulfonyl)pyrrolo[2,3-b]pyridine
5-bromo-3-iodo-1-(toluene-4-sulfonyl)-1H-pyrrolo[2,3-b]pyridine
5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine
5-bromo-3-iodo-1-tosyl-1H-pyrrolo[2,3-6]pyridine
5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (ACI)
5-Bromo-3-iodo-1-(4-methylbenzenesulfonyl)-1H-pyrrolo[2,3-b]pyridine
5-Bromo-3-iodo-1-tosyl-1H-pyrrolo[2,3-b]pyridine

MDL Number

MFCD11616451

FAQ

What is 5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9)?

5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9) is a chemical compound with a complex structure. It features a pyrrolo[2,3-b]pyridine core with bromo and iodo substituents, and a 4-methylphenyl sulfonyl group. This compound is highly reactive and is used in various research and development applications.

What are the main uses of 5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9)?

5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine is primarily used in pharmaceutical research, particularly for synthesizing bioactive compounds and as a tool molecule in medicinal chemistry. It is also of interest in academic settings for studying chemical reactivity and structural diversity.

Is 5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9) safe?

5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9) is not considered safe for general handling due to its chemical reactivity and potential toxicity. Proper protective measures, including gloves, goggles, and lab coats, should always be worn when working with this compound. Ensure good ventilation and avoid skin and eye contact.

How should 5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9) be stored?

5-Bromo-3-iodo-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine (CAS: 875639-15-9) 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 exposure to air and moisture. Ideally, store it in a refrigerator or freezer, but check the manufacturer's guidelines for specific temperature recommendations.