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CS-W001157 4
Total: USD 88.00

2,4-Difluorobenzoylacetonitrile

  • CAS No. 71682-95-6

  • Cat. No. CS-0205261
  • Molecule weight181.14
  • Purity≥97%
  • MDL No.MFCD02260804

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

2,4-Difluorobenzoylacetonitrile|CS-0205261

Structure of 71682-95-6

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General Information

  • CAS No. 71682-95-6
  • Cat. No. CS-0205261
  • Purity ≥97%
  • MDL No. MFCD02260804
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅F₂NO
  • Molecular Weight 181.14
  • Synonym(s) 3-(2,4-difluorophenyl)-3-oxo-propanenitrile
  • SMILES N#CCC(=O)C1=CC=C(F)C=C1F

Synthesis

  • Route1

    References

    • BAYER AKTIENGESELLSCHAFT Patent: WO2003/76405 A1, 2003 ; Location in patent: Page/Page column 72 ;
  • Route2
    • null|null
      773837-37-9
    • In-stock
      2-Bromo-1-(2,4-difluorophenyl)ethan-1-one|CS-W012898
      102429-07-2
    • ~76%
    • 2,4-Difluorobenzoylacetonitrile|CS-0205261
      71682-95-6

    References

    • Patil, Shivaraj P.; Kanawade, Shrikant B.; Shinde, Madhukar P.; Toche, Raghunath B. Indian Journal of Heterocyclic Chemistry, 2011 , vol. 21, # 1 p. 33 - 36
  • Route3
    • null|null
      372-18-9
    • null|null
      143-33-9
    • null|null
      75-36-5
    • ~%
    • 2,4-Difluorobenzoylacetonitrile|CS-0205261
      71682-95-6

    References

    • Journal of Medicinal Chemistry, , vol. 22, # 11 p. 1385 - 1389

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.86
  • LogP   2.06118
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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