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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

2-Nitro-4-((trifluoromethyl)sulfonyl)aniline

  • CAS No. 400-23-7

  • Cat. No. CS-0267960
  • Purity≥97%
  • MDL No.None

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

2-Nitro-4-((trifluoromethyl)sulfonyl)aniline|CS-0267960

Structure of 400-23-7

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General Information

  • CAS No. 400-23-7
  • Cat. No. CS-0267960
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅F₃N₂O₄S
  • Molecular Weight 270.19
  • Synonym(s) 2-Nitro-4-(trifluoromethylsulfonyl)aniline
  • SMILES C1=C(C=C(C(=C1)N)[N+](=O)[O-])S(=O)(=O)C(F)(F)F

Synthesis

  • Route1
    • null|null
      315242-26-3
    • ~%
    • 2-Nitro-4-((trifluoromethyl)sulfonyl)aniline|CS-0267960
      400-23-7

    References

    • NEUROGEN CORPORATION Patent: US2003/36652 A1, 2003 ; US 20030036652 A1
  • Route2
    • 1-Chloro-2-nitro-4-[(trifluoromethyl)sulfonyl]benzene|CS-0074431
      1550-27-2
    • ~%
    • 2-Nitro-4-((trifluoromethyl)sulfonyl)aniline|CS-0267960
      400-23-7

    References

    • Jagupol'skii; Marenez Zhurnal Obshchei Khimii, 1959 , vol. 29, p. 278,280; engl. Ausg. S. 281, 283
  • Route3
    • 1-Chloro-4-((trifluoromethyl)sulfonyl)benzene|CS-0314833
      383-11-9
    • ~%
    • 2-Nitro-4-((trifluoromethyl)sulfonyl)aniline|CS-0267960
      400-23-7

    References

    • Jagupol'skii; Marenez Zhurnal Obshchei Khimii, 1959 , vol. 29, p. 278,280; engl. Ausg. S. 281, 283

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   103.3
  • LogP   1.4705
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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