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CS-W001157 4
Total: USD 88.00

4-Fluoro-N-methylbenzamide

  • CAS No. 701-49-5

  • Cat. No. CS-W018076
  • Purity≥98%
  • MDL No.MFCD00032531

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

4-Fluoro-N-methylbenzamide|CS-W018076

Structure of 701-49-5

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General Information

  • CAS No. 701-49-5
  • Cat. No. CS-W018076
  • Purity ≥98%
  • MDL No. MFCD00032531
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈FNO
  • Molecular Weight None
  • Synonym(s) N-Methyl 4-fluorobenzamide
  • SMILES O=C(NC)C1=CC=C(F)C=C1

Synthesis

  • Route1
    • In-stock
      4-Fluorobenzoic acid|CS-W014393
      456-22-4
    • null|null
      74-89-5
    • ~63%
    • In-stock
      4-Fluoro-N-methylbenzamide|CS-W018076
      701-49-5

    References

    • EVOTEC NEUROSCIENCES GMBH Patent: WO2009/135842 A1, 2009 ; Location in patent: Page/Page column 67-68 ; WO 2009/135842 A1
  • Route2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 16 p. 4501 - 4505
  • Route3
    • null|null
      593-51-1
    • In-stock
      4-Fluorobenzoyl Chloride|CS-0622154
      403-43-0
    • ~73%
    • In-stock
      4-Fluoro-N-methylbenzamide|CS-W018076
      701-49-5

    References

    • Ackermann, Lutz; Lygin, Alexander V.; Hofmann, Nora Angewandte Chemie - International Edition, 2011 , vol. 50, # 28 p. 6379 - 6382

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   29.1
  • LogP   1.1853
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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