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CS-W001157 4
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5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

  • CAS No. 1135283-53-2

  • Cat. No. CS-0131028
  • Molecule weight214.14
  • Purity≥95%
  • MDL No.MFCD11841013

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

5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde|CS-0131028

Structure of 1135283-53-2

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General Information

  • CAS No. 1135283-53-2
  • Cat. No. CS-0131028
  • Purity ≥95%
  • MDL No. MFCD11841013
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅F₃N₂O
  • Molecular Weight 214.14
  • Synonym(s) None
  • SMILES O=CC1=CNC2=NC=C(C(F)(F)F)C=C21

Description

5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde features a rigid heteroaromatic core bearing a trifluoromethyl group and an aldehyde functionality at the 3-position. This electron-deficient scaffold enables direct coupling in cross-coupling reactions and serves as a key building block for bioactive molecules in medicinal chemistry.

Application

5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde serves as a versatile heterocyclic building block for medicinal chemistry and materials science. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the aldehyde functionality enables diverse transformations including reductive amination, Wittig reactions, and condensation with hydrazines or hydroxylamines. Bench-stable and compatible with standard purification methods, it functions effectively in multistep syntheses of bioactive molecules and functionalized scaffolds.

Synthesis

  • Route1
    • In-stock
      5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine|CS-W008572
      1036027-54-9
    • null|null
      100-97-0
    • ~%
    • In-stock
      5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde|CS-0131028
      1135283-53-2

    References

    • US2009/253679 A1, ; Page/Page column 41-42 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H319
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   45.75
  • LogP   2.3942
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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