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CS-W001157 4
Total: USD 88.00

2-(4-Chlorophenyl)-2-(pyridin-2-yl)acetonitrile

  • CAS No. 5005-37-8

  • Cat. No. CS-0317719
  • Purity95+%
  • MDL No.None

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

2-(4-Chlorophenyl)-2-(pyridin-2-yl)acetonitrile|CS-0317719

Structure of 5005-37-8

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General Information

  • CAS No. 5005-37-8
  • Cat. No. CS-0317719
  • Purity 95+%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉ClN₂
  • Molecular Weight 228.68
  • Synonym(s) α-(4-Chlorophenyl)-2-pyridineacetonitrile
  • SMILES C1=CC=NC(=C1)C(C#N)C2=CC=C(C=C2)Cl

Synthesis

  • Route1

    References

    • Herold, Franciszek; Kleps, Jerzy; Anulewicz-Ostrowska, Romana; Szczesna, Beata Journal of Heterocyclic Chemistry, 2002 , vol. 39, # 4 p. 773 - 782
  • Route2

    References

    • Buschauer, Armin Archiv der Pharmazie (Weinheim, Germany), 1989 , vol. 322, p. 165 - 171
  • Route3
    • null|null
      109-09-1
    • ~%
    • 2-(4-Chlorophenyl)-2-(pyridin-2-yl)acetonitrile|CS-0317719
      5005-37-8

    References

    • Hunger; Hoffmann Helvetica Chimica Acta, 1957 , vol. 40, p. 1319,1327

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   36.68
  • LogP   3.39048
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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