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CS-W001157 4
Total: USD 88.00

Methyl 2,6-difluoronicotinate

  • CAS No. 117671-02-0

  • Cat. No. CS-0150857
  • Purity≥98%
  • MDL No.MFCD08704426

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

Methyl 2,6-difluoronicotinate|CS-0150857

Structure of 117671-02-0

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General Information

  • CAS No. 117671-02-0
  • Cat. No. CS-0150857
  • Purity ≥98%
  • MDL No. MFCD08704426
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅F₂NO₂
  • Molecular Weight 173.12
  • Synonym(s) Methyl 2,6-difluoropyridine-3-carboxylate
  • SMILES COC(=O)C1=C(F)N=C(C=C1)F

Synthesis

  • Route1
    • null|null
      67-56-1
    • In-stock
      2,6-Difluoronicotinic acid|CS-0091204
      171178-50-0
    • ~95%
    • In-stock
      Methyl 2,6-difluoronicotinate|CS-0150857
      117671-02-0

    References

    • Hirokawa; Horikawa; Kato Chemical and Pharmaceutical Bulletin, 2000 , vol. 48, # 12 p. 1847 - 1853
  • Route2
    • In-stock
      2,6-Difluoropyridine|CS-W013627
      1513-65-1
    • null|null
      79-22-1
    • ~43%
    • In-stock
      Methyl 2,6-difluoronicotinate|CS-0150857
      117671-02-0

    References

    • E. I. Du Pont de Nemours and Company Patent: US4808721 A1, 1989 ;
  • Route3

    References

    • Sun, Haoran; DiMagno, Stephen G. Chemical Communications, 2007 , # 5 p. 528 - 529

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   1.1464
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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