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CS-W001157 4
Total: USD 88.00

5-Chloro-2-(4-fluorophenyl)-1H-indole

  • CAS No. 76609-16-0

  • Cat. No. CS-0570573
  • Purity≥98%
  • MDL No.None

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

5-Chloro-2-(4-fluorophenyl)-1H-indole|CS-0570573

Structure of 76609-16-0

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General Information

  • CAS No. 76609-16-0
  • Cat. No. CS-0570573
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₉ClFN
  • Molecular Weight 245.68
  • Synonym(s) None
  • SMILES C1=CC(=CC=C1C2=CC3=C(N2)C=CC(=C3)Cl)F

Synthesis

  • Route1
    • N-(4-Chloro-2-methylphenyl)-4-fluorobenzamide|CS-1223406
      592471-25-5
    • ~35%
    • 5-Chloro-2-(4-fluorophenyl)-1H-indole|CS-0570573
      76609-16-0

    References

    • Da Settimo, Federico; Simorini, Francesca; Taliani, Sabrina; La Motta, Concettina; Marini, Anna Maria; Salerno, Silvia; Bellandi, Marusca; Novellino, Ettore; Greco, Giovanni; Cosimelli, Barbara; Da Pozzo, Eleonora; Costa, Barbara; Simola, Nicola; Morelli, Micaela; Martini, Claudia Journal of Medicinal Chemistry, 2008 , vol. 51, # 18 p. 5798 - 5806
  • Route2
    • null|null
      1298069-11-0
    • ~%
    • 5-Chloro-2-(4-fluorophenyl)-1H-indole|CS-0570573
      76609-16-0

    References

    • Brand, Jonathan P.; Chevalley, Clara; Waser, Jerome Beilstein Journal of Organic Chemistry, 2011 , vol. 7, art. no. A65, p. 565 - 569
  • Route3

    References

    • Brand, Jonathan P.; Chevalley, Clara; Waser, Jerome Beilstein Journal of Organic Chemistry, 2011 , vol. 7, art. no. A65, p. 565 - 569

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   15.79
  • LogP   4.6274
  • H_Acceptors   0
  • H_Donors   1
  • Rotatable_Bonds   1

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