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CS-W001157 4
Total: USD 88.00

1-Fluoro-5-methoxy-2-methyl-4-nitrobenzene

  • CAS No. 314298-13-0

  • Cat. No. CS-0132292
  • Molecule weight185.15
  • Purity≥97%
  • MDL No.MFCD15527524

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

1-Fluoro-5-methoxy-2-methyl-4-nitrobenzene|CS-0132292

Structure of 314298-13-0

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General Information

  • CAS No. 314298-13-0
  • Cat. No. CS-0132292
  • Purity ≥97%
  • MDL No. MFCD15527524
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈FNO₃
  • Molecular Weight 185.15
  • Synonym(s) Benzene, 1-fluoro-5-methoxy-2-methyl-4-nitro- (9CI)
  • SMILES O=[N+](C1=C(OC)C=C(F)C(C)=C1)[O-]

Synthesis

  • Route1
    • In-stock
      5-Fluoro-4-methyl-2-nitrophenol|CS-0145360
      83341-28-0
    • null|null
      74-88-4
    • ~89%
    • In-stock
      1-Fluoro-5-methoxy-2-methyl-4-nitrobenzene|CS-0132292
      314298-13-0

    References

    • GLAXOSMITHKLINE LLC; ADJABENG, George; BAUM, Erich; BIFULCO, Neil; DAVIS-WARD, Ronda, G.; DICKERSON, Scott, Howard; DONALDSON, Kelly, Horne; HORNBERGER, Keith; PETROV, Kimberly; RHEAULT, Tara, Renae; SAMMOND, Douglas, McCord; SCHAAF, Gregory, M.; STELLWAGEN, John; UEHLING, David, Edward; WATERSON, Alex, Gregory Patent: WO2010/104899 A1, 2010 ; Location in patent: Page/Page column 108 ; WO 2010/104899 A1
  • Route2
    • 5-Methoxy-2-methyl-4-nitroaniline|CS-0128595
      106579-00-4
    • ~75%
    • In-stock
      1-Fluoro-5-methoxy-2-methyl-4-nitrobenzene|CS-0132292
      314298-13-0

    References

    • The Institute for Pharmaceutical Discovery LLC Patent: US6420426 B1, 2002 ;

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   52.37
  • LogP   2.05092
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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