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CS-W001157 4
Total: USD 88.00

4-(3-Chlorophenyl)benzonitrile

  • CAS No. 5728-39-2

  • Cat. No. CS-0211279
  • Purity≥98%
  • MDL No.MFCD05980369

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

4-(3-Chlorophenyl)benzonitrile|CS-0211279

Structure of 5728-39-2

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General Information

  • CAS No. 5728-39-2
  • Cat. No. CS-0211279
  • Purity ≥98%
  • MDL No. MFCD05980369
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈ClN
  • Molecular Weight 213.66
  • Synonym(s) 3'-CHLORO[1,1'-BIPHENYL]-4-CARBONITRILE
  • SMILES N#CC1=CC=C(C2=CC=CC(Cl)=C2)C=C1

Synthesis

  • Route1
    • 3-Chloro-4'-nitro-1,1'-biphenyl|CS-0679708
      952-22-7
    • ~%
    • 4-(3-Chlorophenyl)benzonitrile|CS-0211279
      5728-39-2

    References

    • Byron,D.J. et al. Journal of the Chemical Society [Section] C: Organic, 1966 , p. 840 - 845

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-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   3.87868
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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