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CS-W001157 4
Total: USD 88.00

2,3,4,5,6-Pentafluorobenzyl acetate

  • CAS No. 2002-93-9

  • Cat. No. CS-0121503
  • Purity≥98%
  • MDL No.MFCD29066392

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

2,3,4,5,6-Pentafluorobenzyl acetate|CS-0121503

Structure of 2002-93-9

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General Information

  • CAS No. 2002-93-9
  • Cat. No. CS-0121503
  • Purity ≥98%
  • MDL No. MFCD29066392
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅F₅O₂
  • Molecular Weight 240.13
  • Synonym(s) Pentafluorobenzyl acetate
  • SMILES CC(OCC1=C(F)C(F)=C(F)C(F)=C1F)=O

Synthesis

  • Route1

    References

    • Chien, Chao-Jung; Charles, M. Judith; Sexton, Kenneth G.; Jeffries, Harvey E. Environmental Science and Technology, 1998 , vol. 32, # 2 p. 299 - 309
  • Route2

    References

    • Brill, Jeffrey H.; Narayanan, Bikshandarkoil A.; McCormick, John P. Applied Spectroscopy, 1991 , vol. 45, # 10 p. 1617 - 1620
  • Route3
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    • 2,3,4,5,6-Pentafluorobenzyl acetate|CS-0121503
      2002-93-9

    References

    • Birchall,J.M.; Haszeldine,R.N. Journal of the Chemical Society, 1961 , p. 3719 - 3727

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.4452
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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