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CS-W001157 4
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1-Phenyl-1H-pyrrole-2-carboxylic acid

  • CAS No. 78540-03-1

  • Cat. No. CS-0206972
  • Molecule weight187.19
  • Purity≥95%
  • MDL No.MFCD05174745

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

1-Phenyl-1H-pyrrole-2-carboxylic acid|CS-0206972

Structure of 78540-03-1

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General Information

  • CAS No. 78540-03-1
  • Cat. No. CS-0206972
  • Purity ≥95%
  • MDL No. MFCD05174745
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉NO₂
  • Molecular Weight 187.19
  • Synonym(s) None
  • SMILES C1=CC=C(C=C1)N2C=CC=C2C(=O)O

Synthesis

  • Route1

    References

    • Nemoto, Koji; Onozawa, Satoru; Egusa, Naoki; Morohashi, Naoya; Hattori, Tetsutaro Tetrahedron Letters, 2009 , vol. 50, # 31 p. 4512 - 4514
  • Route2
    • Methyl 1-phenyl-1H-pyrrole-2-carboxylate|CS-0604339
      35524-54-0
    • ~90%
    • 1-Phenyl-1H-pyrrole-2-carboxylic acid|CS-0206972
      78540-03-1

    References

    • Bilodeau, Francois; Brochu, Marie-Christine; Guimond, Nicolas; Thesen, Kris H.; Forgione, Pat Journal of Organic Chemistry, 2010 , vol. 75, # 5 p. 1550 - 1560
  • Route3
    • null|null
      74889-38-6
    • ~%
    • 1-Phenyl-1H-pyrrole-2-carboxylic acid|CS-0206972
      78540-03-1

    References

    • Cartoon, M. E. K.; Cheeseman, G. W. H. Journal of Organometallic Chemistry, 1982 , vol. 234, # 2 p. 123 - 136

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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