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CS-W001157 4
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4-Fluoro-2-methoxy-5-methylaniline

  • CAS No. 314298-14-1

  • Cat. No. CS-0450884
  • Molecule weight155.17
  • Purity≥98%
  • MDL No.None

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

4-Fluoro-2-methoxy-5-methylaniline|CS-0450884

Structure of 314298-14-1

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General Information

  • CAS No. 314298-14-1
  • Cat. No. CS-0450884
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀FNO
  • Molecular Weight 155.17
  • Synonym(s) Benzenamine, 4-fluoro-2-methoxy-5-methyl- (9CI)
  • SMILES CC1=CC(=C(C=C1F)OC)N

Synthesis

  • Route1

    References

    • The Institute for Pharmaceutical Discovery LLC Patent: US6420426 B1, 2002 ;
  • Route2
    • 5-Methoxy-2-methyl-4-nitroaniline|CS-0128595
      106579-00-4
    • ~%
    • 4-Fluoro-2-methoxy-5-methylaniline|CS-0450884
      314298-14-1

    References

    • Van Zandt, Michael C.; Sibley, Evelyn O.; McCann, Erin E.; Combs, Kerry J.; Flam, Brenda; Sawicki, Diane R.; Sabetta, Al; Carrington, Anne; Sredy, Janet; Howard, Eduardo; Mitschler, Andre; Podjarny, Alberto D. Bioorganic and Medicinal Chemistry, 2004 , vol. 12, # 21 p. 5661 - 5675

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

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Computational Chemistry Data

  • TPSA   35.25
  • LogP   1.72492
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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