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CS-W001157 4
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Phenyl(1H-pyrrol-2-yl)methanone

  • CAS No. 7697-46-3

  • Cat. No. CS-0156555
  • Purity≥98%
  • MDL No.MFCD00094048

*For research and further manufacturing use only, not for direct human use.

Phenyl(1H-pyrrol-2-yl)methanone|CS-0156555

Structure of 7697-46-3

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General Information

  • CAS No. 7697-46-3
  • Cat. No. CS-0156555
  • Purity ≥98%
  • MDL No. MFCD00094048
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉NO
  • Molecular Weight 171.20
  • Synonym(s) 2-Benzoylpyrrole
  • SMILES C1=CC=C(C=C1)C(=O)C2=CC=CN2

Description

Phenyl(1H-pyrrol-2-yl)methanone features a conjugated aryl-pyrrole scaffold with a ketone-linked phenyl group, enabling integration into bioactive scaffolds. This electron-deficient amide delivers enhanced metabolic stability and facilitates efficient coupling in late-stage functionalization workflows.

Application

Phenyl(1H-pyrrol-2-yl)methanone serves as a versatile building block for heterocyclic synthesis, enabling efficient access to biologically relevant scaffolds. Its aryl ketone functionality exhibits robust stability and compatibility with standard reaction conditions, facilitating nucleophilic additions, cross-coupling transformations, and functional group interconversions. The molecule's defined steric and electronic profile supports predictable reactivity in medicinal chemistry workflows, offering reliable performance in multi-step syntheses.

Synthesis

  • Route1
    • null|null
      109-97-7
    • In-stock
      Morpholino(phenyl)methanone|CS-0051030
      1468-28-6
    • ~89%
    • In-stock
      Phenyl(1H-pyrrol-2-yl)methanone|CS-0156555
      7697-46-3

    References

    • Milen, Matyas; Abranyi-Balogh, Peter; Dancso, Andras; Simig, Gyula; Volk, Balazs Tetrahedron, 2014 , vol. 70, # 2 p. 465 - 476
  • Route2
    • null|null
      109-97-7
    • null|null
      98-88-4
    • ~90%
    • In-stock
      Phenyl(1H-pyrrol-2-yl)methanone|CS-0156555
      7697-46-3

    References

    • Boroujeni, Kaveh Parvanak Bulletin of the Korean Chemical Society, 2010 , vol. 31, # 11 p. 3156 - 3158
  • Route3
    • null|null
      109-97-7
    • In-stock
      Benzoic acid|CS-0008257
      65-85-0
    • ~98%
    • In-stock
      Phenyl(1H-pyrrol-2-yl)methanone|CS-0156555
      7697-46-3

    References

    • Firouzabadi, Habib; Iranpoor, Nasser; Nowrouzi, Farhad Tetrahedron, 2004 , vol. 60, # 48 p. 10843 - 10850

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   2.2457
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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