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CS-W001157 4
Total: USD 88.00

3,4-Dimethyl-1H-pyrrole-2-carboxylic acid

  • CAS No. 89776-55-6

  • Cat. No. CS-0051604
  • Purity≥97%
  • MDL No.None

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

3,4-Dimethyl-1H-pyrrole-2-carboxylic acid|CS-0051604

Structure of 89776-55-6

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General Information

  • CAS No. 89776-55-6
  • Cat. No. CS-0051604
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NO₂
  • Molecular Weight 139.15
  • Synonym(s) None
  • SMILES CC1=CNC(C(O)=O)=C1C

Synthesis

  • Route1
    • null|null
      954-92-7
    • ~99%
    • In-stock
      3,4-Dimethyl-1H-pyrrole-2-carboxylic acid|CS-0051604
      89776-55-6

    References

    • Sessler, Jonathan L.; Zimmerman, Rebecca S.; Kirkovits, Gregory J.; Gebauer, Andreas; Scherer, Markus Journal of Organometallic Chemistry, 2001 , vol. 637-639, p. 343 - 348
  • Route2
    • Ethyl 3,4-dimethyl-1H-pyrrole-2-carboxylate|CS-0061545
      938-75-0
    • ~99%
    • In-stock
      3,4-Dimethyl-1H-pyrrole-2-carboxylic acid|CS-0051604
      89776-55-6

    References

    • Roth, Steven D.; Shkindel, Tetyana; Lightner, David A. Tetrahedron, 2007 , vol. 63, # 45 p. 11030 - 11039
  • Route3
    • null|null
      4868-30-8
    • ~%
    • In-stock
      3,4-Dimethyl-1H-pyrrole-2-carboxylic acid|CS-0051604
      89776-55-6

    References

    • Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), , p. 1569 - 1576

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   53.09
  • LogP   1.32974
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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