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CS-W001157 4
Total: USD 88.00

2-(4-Bromo-2-chlorophenyl)acetonitrile

  • CAS No. 67197-54-0

  • Cat. No. CS-0197663
  • Purity≥98%
  • MDL No.None

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

2-(4-Bromo-2-chlorophenyl)acetonitrile|CS-0197663

Structure of 67197-54-0

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General Information

  • CAS No. 67197-54-0
  • Cat. No. CS-0197663
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrClN
  • Molecular Weight 230.49
  • Synonym(s) 4-bromo-2-chlorophenylacetonitrile
  • SMILES C1=CC(=CC(=C1CC#N)Cl)Br

Synthesis

  • Route1
    • null|null
      151-50-8
    • In-stock
      4-Bromo-1-(bromomethyl)-2-chlorobenzene|CS-W010028
      89720-77-4
    • ~99%
    • In-stock
      2-(4-Bromo-2-chlorophenyl)acetonitrile|CS-0197663
      67197-54-0

    References

    • PFIZER INC. Patent: WO2006/18725 A1, 2006 ; Location in patent: Page/Page column 236 ; WO 2006/018725 A1
  • Route2

    References

    • X-Ceptor Therapeutics, Inc. Patent: US2005/80111 A1, 2005 ; US 20050080111 A1
  • Route3

    References

    • AFRAXIS, INC.; CAMPBELL, David; DURÓN, Sergio, G. Patent: WO2013/43232 A2, 2013 ; WO 2013/043232 A2

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   23.79
  • LogP   3.16858
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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