5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde | CAS No. 881676-90-0

5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde

Basic Information

CAS Number

881676-90-0

Molecular Formula

C16H12N2O3S

Molecular Weight

312.34 g/mol

AD

Basic Physical Properties

C1=CC=C(C=C1)C2=CC(=CN2S(=O)(=O)C3=CN=CC=C3)C=O

InChI

1S/C16H12N2O3S/c19-12-13-9-16(14-5-2-1-3-6-14)18(11-13)22(20,21)15-7-4-8-17-10-15/h1-12H

InChIKey

CLFVCXPMUQJUFF-UHFFFAOYSA-N

LogP

2.5996000000000006

Topological Polar Surface Area

69.03 Ų

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

482

Synonyms & References

English

  • 1H-Pyrrole-3-carboxaldehyde, 5-phenyl-1-(3-pyridinylsulfonyl)-
  • 5-phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde
  • 5-Phenyl-1-(3-pyridinylsulfonyl)-1H-pyrrole-3-carboxaldehyde (ACI)
  • 5-Phenyl-1-[(pyridin-3-yl)sulfonyl]-1H-pyrrole-3-carboxaldehyde
  • E82029
  • 5-phenyl-1-pyridin-3-ylsulfonylpyrrole-3-carbaldehyde
  • DB-124057
  • SCHEMBL1156702
  • 881676-90-0
  • 5-Phenyl-1-(3-pyridinesulfonyl)-1H-pyrrole-3-carbaldehyde
  • 5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde
  • 5-phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde (Vonoprazan Impurity pound(c)
  • CS-0163883
  • CLFVCXPMUQJUFF-UHFFFAOYSA-N
  • AS-84854

FAQ

What are the physical and chemical properties of 5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde (CAS: 881676-90-0)?

5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde is a crystalline solid with a high molecular weight. It has a low solubility in water but good solubility in organic solvents like dichloromethane. This compound is relatively stable under normal conditions but can react with nucleophiles, particularly under basic conditions. It is an important precursor in organic synthesis and pharmaceutical research.

How is 5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde (CAS: 881676-90-0) typically synthesized?

5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde is often synthesized via a multistep process involving the coupling of a phenyl group with a pyridin-3-ylsulfonyl group. Commonly, the synthesis involves the use of reagents like sulfonyl chloride and a condensing agent. The process requires careful control of temperature and reaction time to achieve high yield and selectivity.

What industries use 5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde (CAS: 881676-90-0)?

5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde is used in the pharmaceutical and chemical industries. It serves as a key intermediate in the synthesis of various drugs and functional materials. Its applications in semiconductors and organic electronics are also being explored for its unique electronic properties.

What precautions should be taken when handling 5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde (CAS: 881676-90-0)?

When handling 5-Phenyl-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde, it is crucial to use appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Ensure that the work is conducted in a well-ventilated area or a fume hood. Spills should be managed promptly with absorbent materials and cleaned with appropriate solvents. Always refer to the safety data sheet (SDS) for detailed handling instructions and emergency procedures.

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