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CS-W001157 4
Total: USD 88.00

4-Bromo-2-cyanobenzeneacetonitrile

  • CAS No. 925672-89-5

  • Cat. No. CS-0186953
  • Molecule weight221.05
  • Purity≥98%
  • MDL No.None

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

4-Bromo-2-cyanobenzeneacetonitrile|CS-0186953

Structure of 925672-89-5

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General Information

  • CAS No. 925672-89-5
  • Cat. No. CS-0186953
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅BrN₂
  • Molecular Weight 221.05
  • Synonym(s) 5-bromo-2-(cyanomethyl)benzonitrile
  • SMILES C1=C(CC#N)C(=CC(=C1)Br)C#N

Synthesis

  • Route1
    • 5-Bromo-2-fluorobenzonitrile Olaparib Impurity|CS-0214082
      179897-89-3
    • In-stock
      Methyl 2-cyanoacetate|CS-W016657
      105-34-0
    • ~83%
    • In-stock
      4-Bromo-2-cyanobenzeneacetonitrile|CS-0186953
      925672-89-5

    References

    • Frohn, Mike; Buerli, Roland W.; Riahi, Bobby; Hungate, Randall W. Tetrahedron Letters, 2007 , vol. 48, # 3 p. 487 - 489

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   47.58
  • LogP   2.38686
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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