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CS-W001157 4
Total: USD 88.00

3-(Difluoromethoxy)benzonitrile

  • CAS No. 97582-88-2

  • Cat. No. CS-0096818
  • Purity≥98%
  • MDL No.MFCD00236225

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

3-(Difluoromethoxy)benzonitrile|CS-0096818

Structure of 97582-88-2

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General Information

  • CAS No. 97582-88-2
  • Cat. No. CS-0096818
  • Purity ≥98%
  • MDL No. MFCD00236225
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₂NO
  • Molecular Weight 169.13
  • Synonym(s) 3-Cyano-alpha,alpha-difluoroanisole, 3-Cyanophenyl difluoromethyl ether
  • SMILES N#CC1=CC=CC(OC(F)F)=C1

Synthesis

  • Route1
    • null|null
      97603-92-4
    • ~91%
    • In-stock
      3-(Difluoromethoxy)benzonitrile|CS-0096818
      97582-88-2

    References

    • Journal of Medicinal Chemistry, , vol. 33, # 4 p. 1230 - 1241
  • Route2

    References

    • US5731477 A1, ;
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 33, # 4 p. 1230 - 1241

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   2.15968
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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