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CS-W001157 4
Total: USD 88.00

5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid

  • CAS No. 784144-05-4

  • Cat. No. CS-0004435
  • Molecule weight230.14
  • Purity≥97%
  • MDL No.MFCD15529028

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

5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid|CS-0004435

Structure of 784144-05-4

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General Information

  • CAS No. 784144-05-4
  • Cat. No. CS-0004435
  • Purity ≥97%
  • MDL No. MFCD15529028
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅F₃N₂O₂
  • Molecular Weight 230.14
  • Synonym(s) 2-Carboxy-5-(trifluoromethyl)-7-azaindole, 5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
  • SMILES O=C(O)C1=CC2=CC(C(F)(F)F)=CN=C2N1

Synthesis

  • Route1
    • Pyruvic acid, ≥97%|CS-1268663
      127-17-3
    • In-stock
      3-Chloro-5-(trifluoromethyl)pyridin-2-amine|CS-W010581
      79456-26-1
    • ~96%
    • In-stock
      5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid|CS-0004435
      784144-05-4

    References

    • Nazare, Marc; Schneider, Claudia; Lindenschmidt, Andreas; Will, David William Angewandte Chemie - International Edition, 2004 , vol. 43, # 34 p. 4526 - 4528
  • Route2
    • Pyruvic acid, ≥97%|CS-1268663
      127-17-3
    • In-stock
      3-Iodo-5-(trifluoromethyl)pyridin-2-amine|CS-W021943
      211308-82-6
    • ~%
    • In-stock
      5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid|CS-0004435
      784144-05-4

    References

    • SANOFI-AVENTIS Patent: US2008/125459 A1, 2008 ; Location in patent: Page/Page column 14 ;

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   65.98
  • LogP   2.2799
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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