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CS-W001157 4
Total: USD 88.00

5-Fluoro-1-methyl-1h-indole-3-carbaldehyde

  • CAS No. 441715-30-6

  • Cat. No. CS-0214797
  • Purity≥98%
  • MDL No.None

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

5-Fluoro-1-methyl-1h-indole-3-carbaldehyde|CS-0214797

Structure of 441715-30-6

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General Information

  • CAS No. 441715-30-6
  • Cat. No. CS-0214797
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈FNO
  • Molecular Weight 177.18
  • Synonym(s) Albb-005049
  • SMILES CN1C=C(C=O)C2=C1C=CC(=C2)F

Description

5-Fluoro-1-methyl-1H-indole-3-carbaldehyde features a fluorinated indole core with a methyl group at the nitrogen and an aldehyde function at the 3-position. This electron-deficient scaffold integrates readily into synthetic routes for pharmaceutical intermediates, offering enhanced metabolic stability and tunable polarity.

Application

5-Fluoro-1-methyl-1H-indole-3-carbaldehyde serves as a versatile building block in medicinal chemistry, enabling the synthesis of heterocyclic scaffolds via standard coupling and functional group transformation protocols. The aldehyde functionality facilitates efficient derivatization, while the 5-fluoro and 1-methyl substituents enhance metabolic stability and modulate electronic properties. Bench-stable and compatible with common purification methods, it functions reliably in multistep syntheses targeting bioactive molecules.

Synthesis

  • Route1
    • In-stock
      5-Fluoroindole-3-carboxaldehyde|CS-W008994
      2338-71-8
    • null|null
      74-88-4
    • ~97%
    • In-stock
      5-Fluoro-1-methyl-1h-indole-3-carbaldehyde|CS-0214797
      441715-30-6

    References

    • DAIICHI PHARMACEUTICAL CO., LTD. Patent: EP1346982 A1, 2003 ;
  • Route2
    • 5-Fluoro-1-methyl-1h-indole|CS-0687969
      116176-92-2
    • null|null
      68-12-2
    • ~%
    • In-stock
      5-Fluoro-1-methyl-1h-indole-3-carbaldehyde|CS-0214797
      441715-30-6

    References

    • Setoguchi, Masaki; Iimura, Shin; Sugimoto, Yuuichi; Yoneda, Yoshiyuki; Chiba, Jun; Watanabe, Toshiyuki; Muro, Fumihito; Iigo, Yutaka; Takayama, Gensuke; Yokoyama, Mika; Taira, Tomoe; Aonuma, Misato; Takashi, Tohru; Nakayama, Atsushi; MacHinaga, Nobuo Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 3 p. 1201 - 1212
  • Route3
    • 5-Fluoro-1-methyl-1h-indole|CS-0687969
      116176-92-2
    • null|null
      110-18-9
    • ~85%
    • In-stock
      5-Fluoro-1-methyl-1h-indole-3-carbaldehyde|CS-0214797
      441715-30-6

    References

    • Chen, Jianbin; Liu, Bin; Liu, Dongfang; Liu, Shan; Cheng, Jiang Advanced Synthesis and Catalysis, 2012 , vol. 354, # 13 p. 2438 - 2442

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   22
  • LogP   2.1299
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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