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1-(2,2-Difluorobenzo[d][1,3]dioxol-4-yl)ethan-1-one

  • CAS No. 126120-83-0

  • Cat. No. CS-0443683
  • Purity≥98%
  • MDL No.None

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

1-(2,2-Difluorobenzo[d][1,3]dioxol-4-yl)ethan-1-one|CS-0443683

Structure of 126120-83-0

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General Information

  • CAS No. 126120-83-0
  • Cat. No. CS-0443683
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆F₂O₃
  • Molecular Weight 200.14
  • Synonym(s) 4-Acetyl-2,2-difluoro-1,3-benzodioxole
  • SMILES CC(=O)C1=C2C(=CC=C1)OC(F)(F)O2

Synthesis

  • Route1

    References

    • US5194628 A1, ;
  • Route2

    References

    • Schlosser, Manfred; Gorecka, Joanna; Castagnetti, Eva European Journal of Organic Chemistry, 2003 , # 3 p. 452 - 462

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 : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.2107
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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