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CS-W001157 4
Total: USD 88.00

1,3-Diiodo-5-nitrobenzene

  • CAS No. 57830-60-1

  • Cat. No. CS-0236982
  • Molecule weight374.90
  • Purity95+%
  • MDL No.None

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

1,3-Diiodo-5-nitrobenzene|CS-0236982

Structure of 57830-60-1

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General Information

  • CAS No. 57830-60-1
  • Cat. No. CS-0236982
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃I₂NO₂
  • Molecular Weight 374.90
  • Synonym(s) JIVYEUNBDFYQRD-UHFFFAOYSA-N
  • SMILES C=1(C=C(C=C(C1)[N+](=O)[O-])I)I

Synthesis

  • Route1

    References

    • Goerl, Christian; Beck, Nadine; Kleiber, Katharina; Alt, Helmut G. Journal of Molecular Catalysis A: Chemical, 2012 , vol. 352, p. 110 - 127
  • Route2
    • 2,4-Diiodo-6-nitroaniline|CS-0161530
      116529-49-8
    • ~68%
    • 1,3-Diiodo-5-nitrobenzene|CS-0236982
      57830-60-1

    References

    • Hoeger; Bonrad; Mourran; Beginn; Moeller Journal of the American Chemical Society, 2001 , vol. 123, # 24 p. 5651 - 5659
  • Route3

    References

    • Merck and Co., Inc. Patent: US5292879 A1, 1994 ;

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

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   2.804
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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