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CS-W001157 4
Total: USD 88.00

1-(2-Fluorophenyl)prop-2-en-1-one

  • CAS No. 89638-21-1

  • Cat. No. CS-0255769
  • Purity≥97%
  • MDL No.None

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

1-(2-Fluorophenyl)prop-2-en-1-one|CS-0255769

Structure of 89638-21-1

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General Information

  • CAS No. 89638-21-1
  • Cat. No. CS-0255769
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇FO
  • Molecular Weight 150.15
  • Synonym(s) 1-(2-fluorophenyl)-2-Propen-1-one
  • SMILES C=CC(C1=CC=CC=C1F)=O

Synthesis

  • Route1

    References

    • Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH Patent: US2010/331320 A1, 2010 ; Location in patent: Page/Page column 51; 52 ;
  • Route2
    • 1-(2-Fluorophenyl)prop-2-en-1-ol|CS-0225782
      58824-51-4
    • ~52%
    • 1-(2-Fluorophenyl)prop-2-en-1-one|CS-0255769
      89638-21-1

    References

    • Bunce, Richard A.; Nago, Takahiro Journal of Heterocyclic Chemistry, 2009 , vol. 46, # 4 p. 623 - 628

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-H320-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.1944
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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