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CS-W001157 4
Total: USD 88.00

2-(1H-Pyrrol-1-yl)benzoic acid

  • CAS No. 10333-68-3

  • Cat. No. CS-0076546
  • Purity≥97%
  • MDL No.MFCD00051645

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

2-(1H-Pyrrol-1-yl)benzoic acid|CS-0076546

Structure of 10333-68-3

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General Information

  • CAS No. 10333-68-3
  • Cat. No. CS-0076546
  • Purity ≥97%
  • MDL No. MFCD00051645
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉NO₂
  • Molecular Weight 187.19
  • Synonym(s) N-(2-Carboxyphenyl)pyrrole
  • SMILES O=C(O)C(C=CC=C1)=C1N2C=CC=C2

Synthesis

  • Route1
    • In-stock
      1-Phenylpyrrole|CS-0088805
      635-90-5
    • null|null
      124-38-9
    • ~%
    • In-stock
      2-(1H-Pyrrol-1-yl)benzoic acid|CS-0076546
      10333-68-3

    References

    • Tetrahedron, , vol. 49, # 45 p. 10271 - 10278
  • Route2
    • Methyl 2-(1H-pyrrol-1-yl)benzoate|CS-0313324
      10333-67-2
    • ~87%
    • In-stock
      2-(1H-Pyrrol-1-yl)benzoic acid|CS-0076546
      10333-68-3

    References

    • Bailey, A. Sydney; Scott, Peter W.; Vandrevala, Marazban H. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 97 - 101
  • Route3
    • null|null
      696-59-3
    • null|null
      118-92-3
    • ~%
    • In-stock
      2-(1H-Pyrrol-1-yl)benzoic acid|CS-0076546
      10333-68-3

    References

    • Tetrahedron, , vol. 69, # 47 p. 9951 - 9956

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   42.23
  • LogP   2.1755
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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