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CS-W001157 4
Total: USD 88.00

5-Amino-4-fluoro-2-methylphenol

  • CAS No. 122455-85-0

  • Cat. No. CS-W022289
  • Molecule weight141.14
  • Purity≥98%
  • MDL No.MFCD04972656

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

5-Amino-4-fluoro-2-methylphenol|CS-W022289

Structure of 122455-85-0

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General Information

  • CAS No. 122455-85-0
  • Cat. No. CS-W022289
  • Purity ≥98%
  • MDL No. MFCD04972656
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈FNO
  • Molecular Weight 141.14
  • Synonym(s) 5-Amino-4-fluoro-o-cresol
  • SMILES CC1=C(O)C=C(N)C(F)=C1

Synthesis

  • Route1
    • 4-Fluoro-2-methyl-5-nitrophenol|CS-0117812
      122455-84-9
    • ~63%
    • 5-Amino-4-fluoro-2-methylphenol|CS-W022289
      122455-85-0

    References

    • DECIPHERA PHARMACEUTICALS, LLC; FLYNN, Daniel, L.; PETILLO, Peter, A.; KAUFMAN, Michael, D. Patent: WO2010/51373 A1, 2010 ; Location in patent: Page/Page column 69-70 ; WO 2010/051373 A1
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 42, # 26 p. 5369 - 5389
  • Route3
    • 4-Fluoro-2-methylphenyl methyl carbonate|CS-0457278
      122455-86-1
    • ~%
    • 5-Amino-4-fluoro-2-methylphenol|CS-W022289
      122455-85-0

    References

    • Journal of Medicinal Chemistry, , vol. 42, # 26 p. 5369 - 5389

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.25
  • LogP   1.42192
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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