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CS-W001157 4
Total: USD 88.00

1-(1-(Phenylsulfonyl)-1H-pyrrol-2-yl)ethan-1-one

  • CAS No. 86688-88-2

  • Cat. No. CS-0548099
  • Purity≥98%
  • MDL No.None

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

1-(1-(Phenylsulfonyl)-1H-pyrrol-2-yl)ethan-1-one|CS-0548099

Structure of 86688-88-2

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General Information

  • CAS No. 86688-88-2
  • Cat. No. CS-0548099
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO₃S
  • Molecular Weight 249.29
  • Synonym(s) 2-Acetyl-1-(phenylsulfonyl)pyrrole
  • SMILES CC(=O)C1=CC=CN1S(=O)(=O)C2=CC=CC=C2

Synthesis

  • Route1
    • In-stock
      1-(Phenylsulfonyl)-1H-pyrrole|CS-W015264
      16851-82-4
    • null|null
      64-19-7
    • ~81%
    • 3-Acetyl-1-(phenylsulfonyl)pyrrole|CS-0204548
      81453-98-7
    • 1-(1-(Phenylsulfonyl)-1H-pyrrol-2-yl)ethan-1-one|CS-0548099
      86688-88-2

    References

    • Kakushima, Masatoshi; Hamel, Pierre; Frenette, Richard; Rokach, Joshua Journal of Organic Chemistry, 1983 , vol. 48, # 19 p. 3214 - 3219
  • Route2
    • In-stock
      1-(Phenylsulfonyl)-1H-pyrrole|CS-W015264
      16851-82-4
    • null|null
      108-24-7
    • ~93%
    • 3-Acetyl-1-(phenylsulfonyl)pyrrole|CS-0204548
      81453-98-7
    • 1-(1-(Phenylsulfonyl)-1H-pyrrol-2-yl)ethan-1-one|CS-0548099
      86688-88-2

    References

    • Journal of Organic Chemistry, , vol. 69, # 3 p. 680 - 688
  • Route3
    • null|null
      98-09-9
    • ~%
    • 1-(1-(Phenylsulfonyl)-1H-pyrrol-2-yl)ethan-1-one|CS-0548099
      86688-88-2

    References

    • Tetrahedron Letters, , vol. 22, # 49 p. 4899 - 4900

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   56.14
  • LogP   1.9277
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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