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CS-W001157 4
Total: USD 88.00

1-Iodo-4-methyl-2-nitrobenzene

  • CAS No. 5326-39-6

  • Cat. No. CS-W002146
  • Purity≥98%
  • MDL No.MFCD00024196

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

1-Iodo-4-methyl-2-nitrobenzene|CS-W002146

Structure of 5326-39-6

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General Information

  • CAS No. 5326-39-6
  • Cat. No. CS-W002146
  • Purity ≥98%
  • MDL No. MFCD00024196
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆INO₂
  • Molecular Weight 263.03
  • Synonym(s) 4-Iodo-3-nitrotoluene
  • SMILES Cc1ccc(c(c1)[N+](=O)[O-])I

Synthesis

  • Route1
    • null|null
      89-62-3
    • ~83%
    • In-stock
      1-Iodo-4-methyl-2-nitrobenzene|CS-W002146
      5326-39-6

    References

    • Wetzel, Alexander; Gagosz, Fabien Angewandte Chemie - International Edition, 2011 , vol. 50, # 32 p. 7354 - 7358
  • Route2

    References

    • Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), , p. 1281 - 1286
  • Route3

    References

    • Journal of Organic Chemistry USSR (English Translation), , vol. 24, # 11 p. 2029 - 2035 Zhurnal Organicheskoi Khimii, , vol. 24, # 11 p. 2251 - 2258

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   2.50782
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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