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CS-W001157 4
Total: USD 88.00

2,4-Difluoro-6-methoxybenzonitrile

  • CAS No. 1240518-41-5

  • Cat. No. CS-0443240
  • Purity≥98%
  • MDL No.None

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

2,4-Difluoro-6-methoxybenzonitrile|CS-0443240

Structure of 1240518-41-5

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General Information

  • CAS No. 1240518-41-5
  • Cat. No. CS-0443240
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₂NO
  • Molecular Weight 169.13
  • Synonym(s) 2,4-difluoro-6-(methyloxy)benzonitrile
  • SMILES COC1=CC(=CC(=C1C#N)F)F

Synthesis

  • Route1
    • 2,4-Difluoro-6-methoxybenzaldehyde|CS-0465970
      608515-57-7
    • ~95%
    • 2,4-Difluoro-6-methoxybenzonitrile|CS-0443240
      1240518-41-5

    References

    • Procopiou, Panayiotis A.; Barrett, John W.; Barton, Nicholas P.; Begg, Malcolm; Clapham, David; Copley, Royston C. B.; Ford, Alison J.; Graves, Rebecca H.; Hall, David A.; Hancock, Ashley P.; Hill, Alan P.; Hobbs, Heather; Hodgson, Simon T.; Jumeaux, Coline; Lacroix, Yannick M. L.; Miah, Afjal H.; Morriss, Karen M. L.; Needham, Deborah; Sheriff, Emma B.; Slack, Robert J.; Smith, Claire E.; Sollis, Steven L.; Staton, Hugo Journal of Medicinal Chemistry, 2013 , vol. 56, # 5 p. 1946 - 1960
  • Route2

    References

    • Hodgson, Simon Teanby; Lacroix, Yannick Maurice; Procopiou, Pauayiotis Alexandron Patent: US2010/216860 A1, 2010 ; Location in patent: Page/Page column 29 ; US 20100216860 A1
  • Route3

    References

    • Procopiou, Panayiotis A.; Barrett, John W.; Barton, Nicholas P.; Begg, Malcolm; Clapham, David; Copley, Royston C. B.; Ford, Alison J.; Graves, Rebecca H.; Hall, David A.; Hancock, Ashley P.; Hill, Alan P.; Hobbs, Heather; Hodgson, Simon T.; Jumeaux, Coline; Lacroix, Yannick M. L.; Miah, Afjal H.; Morriss, Karen M. L.; Needham, Deborah; Sheriff, Emma B.; Slack, Robert J.; Smith, Claire E.; Sollis, Steven L.; Staton, Hugo Journal of Medicinal Chemistry, 2013 , vol. 56, # 5 p. 1946 - 1960

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   1.84508
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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