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CS-W001157 4
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1-Fluoro-2-methyl-3,5-dinitrobenzene

  • CAS No. 85233-16-5

  • Cat. No. CS-0438494
  • Molecule weight200.12
  • Purity≥98%
  • MDL No.None

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

1-Fluoro-2-methyl-3,5-dinitrobenzene|CS-0438494

Structure of 85233-16-5

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General Information

  • CAS No. 85233-16-5
  • Cat. No. CS-0438494
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅FN₂O₄
  • Molecular Weight 200.12
  • Synonym(s) Benzene, 1-fluoro-2-methyl-3,5-dinitro-
  • SMILES O=[N+](C1=CC([N+]([O-])=O)=C(C)C(F)=C1)[O-]

Synthesis

  • Route1
    • null|null
      121-14-2
    • ~10%
    • 1-Fluoro-2-methyl-3,5-dinitrobenzene|CS-0438494
      85233-16-5

    References

    • Chambers, Richard D.; Fox, Mark A.; Sandford, Graham; Trmcic, Jelena; Goeta, Andres Journal of Fluorine Chemistry, 2007 , vol. 128, # 1 p. 29 - 33

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   86.28
  • LogP   1.95052
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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