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CS-W001157 4
Total: USD 88.00

Diethyl (bromodifluoromethyl)phosphonate

  • CAS No. 65094-22-6

  • Cat. No. CS-W007406
  • Purity≥95%
  • MDL No.MFCD00069118

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

Diethyl (bromodifluoromethyl)phosphonate|CS-W007406

Structure of 65094-22-6

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General Information

  • CAS No. 65094-22-6
  • Cat. No. CS-W007406
  • Purity ≥95%
  • MDL No. MFCD00069118
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₁₀BrF₂O₃P
  • Molecular Weight 267.01
  • Synonym(s) Diethyl bromodifluoromethanephosphonate
  • SMILES CCOP(=O)(OCC)C(F)(F)Br

Description

Reactant for:Preparation of phosphopeptide mimetic prodrugs targeted to Src homology 2 (SH2) domain of signal transducer and activator of transcription 3 (Stat3)Synthesis of Mycobacterium tuberculosis protein tyrosine phosphatase inhibitory difluoromethylphosphonic acid derivatives via multi step synthesis with Suzuki coupling and resolution as key stepsP-C bond cleavage on basic hydrolysisPreparation of a prodrug for intracellular delivery of protein tyrosine phosphatase 1B (PTP1B) inhibitor (nonhydrolyzable difluoromethylphosphonate moiety)

Synthesis

  • Route1
    • null|null
      75-61-6
    • null|null
      122-52-1
    • ~93%
    • In-stock
      Diethyl (bromodifluoromethyl)phosphonate|CS-W007406
      65094-22-6

    References

    • Kolb, Hartmuth C.; Richardson, Paul F.; Kanamarlapudi, Ramanaiah C. Patent: US2004/225146 A1, 2004 ; Location in patent: Page 4 ; US 20040225146 A1
  • Route2
    • null|null
      353-59-3
    • null|null
      122-52-1
    • ~20%
    • In-stock
      Diethyl (bromodifluoromethyl)phosphonate|CS-W007406
      65094-22-6

    References

    • Flynn, Richard M.; Burton, Donald J. Journal of Fluorine Chemistry, 2011 , vol. 132, # 10 p. 815 - 828
  • Route3
    • null|null
      180627-08-1
    • ~98%
    • In-stock
      Diethyl (bromodifluoromethyl)phosphonate|CS-W007406
      65094-22-6

    References

    • Arnone, Alberto; Novo, Barbara; Pregnolato, Massimo; Resnati, Giuseppe; Terreni, Marco Journal of Organic Chemistry, 1997 , vol. 62, # 18 p. 6401 - 6403

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   3.1977
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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