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CS-W001157 4
Total: USD 88.00

1-Fluoro-2-iodo-3-nitrobenzene

  • CAS No. 122455-36-1

  • Cat. No. CS-0099115
  • Purity≥98%
  • MDL No.None

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

1-Fluoro-2-iodo-3-nitrobenzene|CS-0099115

Structure of 122455-36-1

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General Information

  • CAS No. 122455-36-1
  • Cat. No. CS-0099115
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃FINO₂
  • Molecular Weight 267.00
  • Synonym(s) 2-IODO-3-FLUORONITROBENZENE
  • SMILES O=[N+]([O-])C1=C(C(F)=CC=C1)I

Synthesis

  • Route1
    • 2-Fluoro-6-nitrophenyl trifluoromethanesulfonate|CS-0874052
      122455-35-0
    • ~80%
    • In-stock
      1-Fluoro-2-iodo-3-nitrobenzene|CS-0099115
      122455-36-1

    References

    • AstraZeneca AB Patent: US2007/142328 A1, 2007 ; Location in patent: Page/Page column 98-99 ; US 20070142328 A1
  • Route2
    • In-stock
      N-Methylpyrrolidone|CS-0017258
      872-50-4
    • 2-Fluoro-6-nitrophenyl trifluoromethanesulfonate|CS-0874052
      122455-35-0
    • ~%
    • In-stock
      1-Fluoro-2-iodo-3-nitrobenzene|CS-0099115
      122455-36-1

    References

    • US4822781 A1, ;
  • Route3

    References

    • Journal of Organic Chemistry, , vol. 76, # 9 p. 3416 - 3437

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   43.14
  • LogP   2.3385
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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