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CS-W001157 4
Total: USD 88.00

9-Fluoro-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole

  • CAS No. 919120-68-6

  • Cat. No. CS-0271489
  • Purity≥98%
  • MDL No.None

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

9-Fluoro-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole|CS-0271489

Structure of 919120-68-6

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General Information

  • CAS No. 919120-68-6
  • Cat. No. CS-0271489
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃FN₂
  • Molecular Weight 204.24
  • Synonym(s) Azepino[4,3-b]indole,9-fluoro-1,2,3,4,5,6-hexahydro
  • SMILES C1CC2=C(CNC1)C3=C(C=CC(=C3)F)N2

Synthesis

  • Route1
    • 9-Fluoro-1h,2h,3h,4h,5h,6h-azepino[4,3-b]indol-1-one|CS-0237376
      1009631-14-4
    • ~%
    • 9-Fluoro-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole|CS-0271489
      919120-68-6

    References

    • Ivachtchenko, Alexandre Vasilevich; Frolov, Eugene Borisovich; Mitkin, Oleg Dmitrievich; Tkachenko, Sergey Evgenevich; Khvat, Alexandre Letters in Drug Design and Discovery, 2010 , vol. 7, # 6 p. 446 - 451
  • Route2
    • null|null
      1324008-36-7
    • ~%
    • 9-Fluoro-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole|CS-0271489
      919120-68-6

    References

    • Ivachtchenko, Alexandre Vasilevich; Frolov, Eugene Borisovich; Mitkin, Oleg Dmitrievich; Tkachenko, Sergey Evgenevich; Khvat, Alexandre Letters in Drug Design and Discovery, 2010 , vol. 7, # 6 p. 446 - 451

Safety Information

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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   27.82
  • LogP   2.3428
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   0

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