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CS-W001157 4
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1-(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)ethan-1-one

  • CAS No. 136593-45-8

  • Cat. No. CS-0508022
  • Purity≥98%
  • MDL No.MFCD07777109

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

1-(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)ethan-1-one|CS-0508022

Structure of 136593-45-8

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General Information

  • CAS No. 136593-45-8
  • Cat. No. CS-0508022
  • Purity ≥98%
  • MDL No. MFCD07777109
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆F₂O₃
  • Molecular Weight 200.14
  • Synonym(s) 5-Acetyl-2,2-difluoro-1,3-benzodioxole
  • SMILES FC1(F)OC2=CC=C(C(C)=O)C=C2O1

Synthesis

  • Route1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 20, # 4 p. 1432 - 1435

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

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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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