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CS-W001157 4
Total: USD 88.00

4-Bromo-2-(trifluoromethyl)benzonitrile

  • CAS No. 191165-13-6

  • Cat. No. CS-W007955
  • Purity≥98%
  • MDL No.MFCD06659466

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

4-Bromo-2-(trifluoromethyl)benzonitrile|CS-W007955

Structure of 191165-13-6

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General Information

  • CAS No. 191165-13-6
  • Cat. No. CS-W007955
  • Purity ≥98%
  • MDL No. MFCD06659466
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₃BrF₃N
  • Molecular Weight 250.02
  • Synonym(s) 5-Bromo-2-cyanobenzotrifluoride
  • SMILES BrC1=CC(=C(C#N)C=C1)C(F)(F)F

Synthesis

  • Route1

    References

    • Endorecherche, Inc. Patent: US2004/6134 A1, 2004 ; US 20040006134 A1
  • Route2
    • In-stock
      5-Bromo-2-fluorobenzotrifluoride|CS-W014137
      393-37-3
    • null|null
      151-50-8
    • ~%
    • In-stock
      4-Bromo-2-(trifluoromethyl)benzonitrile|CS-W007955
      191165-13-6

    References

    • WO2006/21759 A1, ; Page/Page column 41 ; WO 2006/021759 A1

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   23.79
  • LogP   3.33958
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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