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CS-W001157 4
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2-(2-Fluorophenyl)-2-hydroxyacetic acid

  • CAS No. 389-31-1

  • Cat. No. CS-0059253
  • Purity≥97%
  • MDL No.None

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

2-(2-Fluorophenyl)-2-hydroxyacetic acid|CS-0059253

Structure of 389-31-1

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General Information

  • CAS No. 389-31-1
  • Cat. No. CS-0059253
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇FO₃
  • Molecular Weight 170.14
  • Synonym(s) 2-Fluoromandelic acid
  • SMILES O=C(O)C(O)C1=CC=CC=C1F

Synthesis

  • Route1
    • 2-(2-Fluorophenyl)-2-hydroxyacetonitrile|CS-0733534
      133721-88-7
    • ~53%
    • In-stock
      2-(2-Fluorophenyl)-2-hydroxyacetic acid|CS-0059253
      389-31-1

    References

    • Larsen, Sine; Marthi, Katalin Acta Crystallographica, Section B: Structural Science, 1994 , vol. 50, # 3 p. 373 - 381
  • Route2

    References

    • Astles, Peter C.; Brown, Thomas J.; Halley, Frank; Handscombe, Caroline M.; Harris, Neil V.; Majid, Tahir N.; McCarthy, Clive; McLay, Lain M.; Morley, Andrew; Porter, Barry; Roach, Alan G.; Sargent, Carol; Smith, Christopher; Walsh, Roger J. A. Journal of Medicinal Chemistry, 2000 , vol. 43, # 5 p. 900 - 910
  • Route3

    References

    • Larsen, Sine; Marthi, Katalin Acta Crystallographica, Section B: Structural Science, 1994 , vol. 50, # 3 p. 373 - 381

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   0.9437
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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