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CS-W001157 4
Total: USD 88.00

3-(2,3-Difluorophenyl)propanoic acid

  • CAS No. 412961-26-3

  • Cat. No. CS-0216839
  • Molecule weight186.16
  • Purity≥95%
  • MDL No.None

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

3-(2,3-Difluorophenyl)propanoic acid|CS-0216839

Structure of 412961-26-3

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General Information

  • CAS No. 412961-26-3
  • Cat. No. CS-0216839
  • Purity ≥95%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈F₂O₂
  • Molecular Weight 186.16
  • Synonym(s) 3-(2,3-DIFLUOROPHENYL)PROPIONIC ACID
  • SMILES C1=CC(=C(C(=C1)F)F)CCC(=O)O

Synthesis

  • Route1
    • 2,3-Difluorocinnamic acid|CS-0192575
      207981-48-4
    • ~97%
    • 3-(2,3-Difluorophenyl)propanoic acid|CS-0216839
      412961-26-3

    References

    • GLAXO GROUP LIMITED Patent: WO2003/87088 A2, 2003 ; Location in patent: Page/Page column 42 ; WO 03/087088 A2
  • Route2

    References

    • SYNGENTA PARTICIPATIONS AG; SYNGENTA LIMITED Patent: WO2007/20377 A2, 2007 ; Location in patent: Page/Page column 161 ;

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   37.3
  • LogP   1.982
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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