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CS-W001157 4
Total: USD 88.00

2-(1H-Pyrazol-1-yl)benzonitrile

  • CAS No. 25775-03-5

  • Cat. No. CS-0202142
  • Molecule weight169.18
  • Purity≥98%
  • MDL No.None

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

2-(1H-Pyrazol-1-yl)benzonitrile|CS-0202142

Structure of 25775-03-5

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General Information

  • CAS No. 25775-03-5
  • Cat. No. CS-0202142
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇N₃
  • Molecular Weight 169.18
  • Synonym(s) 1-o-Cyanophenyl-pyrazol
  • SMILES N#CC1=CC=CC=C1N2N=CC=C2

Synthesis

  • Route1
    • In-stock
      1H-pyrazole|CS-W008829
      288-13-1
    • null|null
      394-47-8
    • ~%
    • In-stock
      2-(1H-Pyrazol-1-yl)benzonitrile|CS-0202142
      25775-03-5

    References

    • GRAFFINITY PHARMACEUTICALS AG Patent: WO2005/95343 A1, 2005 ; Location in patent: Page/Page column 53-54 ; WO 2005/095343 A1
  • Route2
    • null|null
      544-92-3
    • null|null
      151-50-8
    • In-stock
      2-(1H-pyrazol-1-yl)aniline|CS-W000146
      54705-91-8
    • ~63%
    • In-stock
      2-(1H-Pyrazol-1-yl)benzonitrile|CS-0202142
      25775-03-5

    References

    • De La Hoz, Antonio; Diaz-Ortiz, Angel; Elguero, Jose; Martinez, Luis J.; Moreno, Andres; Sanchez-Migallon, Ana Tetrahedron, 2001 , vol. 57, # 20 p. 4397 - 4403
  • Route3
    • In-stock
      1-Phenylpyrazole|CS-0076023
      1126-00-7
    • null|null
      140-29-4
    • ~44%
    • In-stock
      2-(1H-Pyrazol-1-yl)benzonitrile|CS-0202142
      25775-03-5

    References

    • Jin, Jisong; Wen, Qiaodong; Lu, Ping; Wang, Yanguang Chemical Communications, 2012 , vol. 48, # 79 p. 9933 - 9935

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
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   41.61
  • LogP   1.74398
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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