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CS-W001157 4
Total: USD 88.00

4-(3-Bromophenyl)tetrahydro-2h-pyran-4-carbonitrile

  • CAS No. 245439-36-5

  • Cat. No. CS-0207876
  • Molecule weight266.13
  • Purity98+%
  • MDL No.MFCD08277238

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

4-(3-Bromophenyl)tetrahydro-2h-pyran-4-carbonitrile|CS-0207876

Structure of 245439-36-5

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General Information

  • CAS No. 245439-36-5
  • Cat. No. CS-0207876
  • Purity 98+%
  • MDL No. MFCD08277238
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂BrNO
  • Molecular Weight 266.13
  • Synonym(s) 4-(3-BROMOPHENYL)TETRAHYDROPYRAN-4-CARBONITRILE
  • SMILES C1=CC(=CC(=C1)Br)C2(CCOCC2)C#N

Synthesis

  • Route1
    • null|null
      31938-07-5
    • null|null
      111-44-4
    • ~69%
    • 4-(3-Bromophenyl)tetrahydro-2h-pyran-4-carbonitrile|CS-0207876
      245439-36-5

    References

    • Norris, Timothy; Leeman, Kyle Organic Process Research and Development, 2008 , vol. 12, # 5 p. 869 - 876
  • Route2
    • null|null
      108-20-3
    • null|null
      31938-07-5
    • null|null
      111-44-4
    • ~80%
    • 4-(3-Bromophenyl)tetrahydro-2h-pyran-4-carbonitrile|CS-0207876
      245439-36-5

    References

    • Pfizer Inc. Patent: US6194585 B1, 2001 ;
  • Route3
    • null|null
      31938-07-5
    • In-stock
      Tetrabutylammonium sulfate,50 wt. % in H2O|CS-0113107
      2472-88-0
    • null|null
      111-44-4
    • ~67%
    • 4-(3-Bromophenyl)tetrahydro-2h-pyran-4-carbonitrile|CS-0207876
      245439-36-5

    References

    • Pfizer Inc Patent: US6346624 B1, 2002 ; Location in patent: Page column 36 ;

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   33.02
  • LogP   3.02088
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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