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CS-W001157 4
Total: USD 88.00

3-(5-Fluoro-1H-indol-3-yl)propanoic acid

  • CAS No. 7394-78-7

  • Cat. No. CS-0047092
  • Purity≥96%
  • MDL No.None

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

3-(5-Fluoro-1H-indol-3-yl)propanoic acid|CS-0047092

Structure of 7394-78-7

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General Information

  • CAS No. 7394-78-7
  • Cat. No. CS-0047092
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀FNO₂
  • Molecular Weight 207.20
  • Synonym(s) 3-(5-Fluoro-3-indolyl)propanoic Acid
  • SMILES O=C(CCC1=CNC2=CC=C(F)C=C21)O

Synthesis

  • Route1
    • In-stock
      5-Fluoroindole|CS-D0680
      399-52-0
    • null|null
      79-10-7
    • ~56%
    • In-stock
      3-(5-Fluoro-1H-indol-3-yl)propanoic acid|CS-0047092
      7394-78-7

    References

    • Bristol-Myers Squibb Company Patent: US5434154 A1, 1995 ; US 5434154 A
  • Route2
    • Ethyl 3-(5-fluoro-1H-indol-3-yl)propanoate|CS-0519366
      221188-30-3
    • ~%
    • In-stock
      3-(5-Fluoro-1H-indol-3-yl)propanoic acid|CS-0047092
      7394-78-7

    References

    • Menciu, Cecilia; Duflos, Muriel; Fouchard, Fabienne; Le Baut, Guillaume; Emig, Peter; Achterrath, Ute; Szelenyi, Istvan; Nickel, Bernd; Schmidt, Juergen; Kutscher, Bernhard; Guenther, Eckhardt Journal of Medicinal Chemistry, 1999 , vol. 42, # 4 p. 638 - 648
  • Route3

    References

    • Menciu, Cecilia; Duflos, Muriel; Fouchard, Fabienne; Le Baut, Guillaume; Emig, Peter; Achterrath, Ute; Szelenyi, Istvan; Nickel, Bernd; Schmidt, Juergen; Kutscher, Bernhard; Guenther, Eckhardt Journal of Medicinal Chemistry, 1999 , vol. 42, # 4 p. 638 - 648

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

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   2.3242
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   3

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