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CS-W001157 4
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3-(3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)acrylic acid

  • CAS No. 108446-72-6

  • Cat. No. CS-0369075
  • Molecule weight308.31
  • Purity≥95%
  • MDL No.None

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

3-(3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)acrylic acid|CS-0369075

Structure of 108446-72-6

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General Information

  • CAS No. 108446-72-6
  • Cat. No. CS-0369075
  • Purity ≥95%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₃FN₂O₂
  • Molecular Weight 308.31
  • Synonym(s) 3-[3-(4-Fluoro-phenyl)-1-phenyl-1H-pyrazol-4-yl]-acrylic acid
  • SMILES O=C(O)/C=C/C1=CN(C2=CC=CC=C2)N=C1C3=CC=C(F)C=C3

Synthesis

  • Route1
    • null|null
      141-82-2
    • 3-(4-Fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde|CS-M1034
      36640-40-1
    • ~75%
    • 3-(3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)acrylic acid|CS-0369075
      108446-72-6
    • null|null
      108446-66-8

    References

    • Bernard; Hulley; Molenda; Stochla; Wrzeciono Die Pharmazie, 1986 , vol. 41, # 8 p. 560 - 562
  • Route2
    • null|null
      141-82-2
    • 3-(4-Fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde|CS-M1034
      36640-40-1
    • ~95%
    • 3-(3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)acrylic acid|CS-0369075
      108446-72-6

    References

    • Chornous, Vitaliy O.; Bratenko, Mykhaylo K.; Vovk, Mykhaylo V. Synthetic Communications, 2004 , vol. 34, # 1 p. 79 - 83
  • Route3
    • null|null
      1994-40-7
    • ~%
    • 3-(3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)acrylic acid|CS-0369075
      108446-72-6

    References

    • Bernard; Hulley; Molenda; Stochla; Wrzeciono Die Pharmazie, 1986 , vol. 41, # 8 p. 560 - 562

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.12
  • LogP   3.7762
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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