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CS-W001157 4
Total: USD 88.00

3-(Trifluoromethyl)cinnamic acid

  • CAS No. 779-89-5

  • Cat. No. CS-M1820
  • Purity≥98%
  • MDL No.MFCD00004393

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

3-(Trifluoromethyl)cinnamic acid|CS-M1820

Structure of 779-89-5

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General Information

  • CAS No. 779-89-5
  • Cat. No. CS-M1820
  • Purity ≥98%
  • MDL No. MFCD00004393
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇F₃O₂
  • Molecular Weight 216.16
  • Synonym(s) None
  • SMILES O=C(O)C=CC1=CC=CC(C(F)(F)F)=C1

Synthesis

  • Route1
    • null|null
      1015065-52-7
    • ~%
    • In-stock
      3-(Trifluoromethyl)cinnamic acid|CS-M1820
      779-89-5

    References

    • WO2008/35381 A2, ; Page/Page column 24 ;
  • Route2
    • In-stock
      1-Iodo-3-(trifluoromethyl)benzene|CS-W003967
      401-81-0
    • null|null
      292638-85-8
    • ~96%
    • In-stock
      3-(Trifluoromethyl)cinnamic acid|CS-M1820
      779-89-5

    References

    • Schweizer, Stephane; Becht, Jean-Michel; Le Drian, Claude Advanced Synthesis and Catalysis, 2007 , vol. 349, # 7 p. 1150 - 1158
  • Route3
    • null|null
      141-82-2
    • In-stock
      3-(Trifluoromethyl)benzaldehyde|CS-M1039
      454-89-7
    • ~73%
    • In-stock
      3-(Trifluoromethyl)cinnamic acid|CS-M1820
      779-89-5

    References

    • Bijukumar, Gopinathenpillai; Maloyesh, Biswas; Bhaskar, Bhirud Shekhar; Rajendra, Agarwal Synthetic Communications, 2008 , vol. 38, # 10 p. 1512 - 1517

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-H335
Precautionary Statements : P233-P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.8032
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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