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CS-W001157 4
Total: USD 88.00

2,6-Diiodo-4-nitroaniline

  • CAS No. 5398-27-6

  • Cat. No. CS-0138268
  • Purity≥97%
  • MDL No.MFCD00007683

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

2,6-Diiodo-4-nitroaniline|CS-0138268

Structure of 5398-27-6

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General Information

  • CAS No. 5398-27-6
  • Cat. No. CS-0138268
  • Purity ≥97%
  • MDL No. MFCD00007683
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄I₂N₂O₂
  • Molecular Weight 389.92
  • Synonym(s) 1-(3-methylphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
  • SMILES NC1=C(I)C=C([N+]([O-])=O)C=C1I

Synthesis

  • Route1
    • null|null
      100-01-6
    • ~90%
    • In-stock
      2,6-Diiodo-4-nitroaniline|CS-0138268
      5398-27-6

    References

    • Chaikovskii; Filimonov; Kharlova; Chernova; Sharapova Russian Journal of Organic Chemistry, 2000 , vol. 36, # 5 p. 666 - 670
  • Route2

    References

    • Journal of Molecular Structure, , vol. 1054-1055, p. 367 - 374
  • Route3

    References

    • Garden, Simon J.; Torres, Jose C.; De Souza Melo, Simone C.; Lima, Alexandre S.; Pinto, Angelo C.; Lima, Edson L.S. Tetrahedron Letters, 2001 , vol. 42, # 11 p. 2089 - 2092

Safety Information

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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   69.16
  • LogP   2.3862
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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