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CS-W001157 4
Total: USD 88.00

4-Amino-3,5-dinitrobenzoic acid

  • CAS No. 7221-27-4

  • Cat. No. CS-0213201
  • Purity98+%
  • MDL No.MFCD00017010

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

4-Amino-3,5-dinitrobenzoic acid|CS-0213201

Structure of 7221-27-4

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General Information

  • CAS No. 7221-27-4
  • Cat. No. CS-0213201
  • Purity 98+%
  • MDL No. MFCD00017010
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅N₃O₆
  • Molecular Weight 227.13
  • Synonym(s) CHRYSANISIC ACID
  • SMILES C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C(=O)O

Synthesis

  • Route1
    • 4-Amino-3,5-dinitrobenzamide|CS-0465800
      54321-79-8
    • ~%
    • 4-Amino-3,5-dinitrobenzoic acid|CS-0213201
      7221-27-4

    References

    • THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK Patent: WO2008/130669 A1, 2008 ; Location in patent: Page/Page column 18-19 ; WO 2008/130669 A1
  • Route2
    • null|null
      118-97-8
    • ~97%
    • 4-Amino-3,5-dinitrobenzoic acid|CS-0213201
      7221-27-4

    References

    • Elkin; Tolkacheva; Chernysheva; Karmanova; Konyushkin; Semenov Russian Chemical Bulletin, 2007 , vol. 56, # 6 p. 1216 - 1226
  • Route3
    • 4-Methoxy-3,5-dinitrobenzoic acid|CS-0317093
      85365-92-0
    • ~%
    • 4-Amino-3,5-dinitrobenzoic acid|CS-0213201
      7221-27-4

    References

    • Cahours Annales de Chimie (Cachan, France), 1849 , vol. <3> 27, p. 465 Justus Liebigs Annalen der Chemie, 1850 , vol. 74, p. 315 Show Details Engelhardt; Latschinow Zhurnal Russkago Fiziko-Khimicheskago Obshchestva, 1871 , vol. 3, p. 187 Zeitschrift fuer Chemie, 1871 , p. 261 Show Details Salkowski Justus Liebigs Annalen der Chemie, 1872 , vol. 163, p. 28 Show Details Beilstein; Kellner Justus Liebigs Annalen der Chemie, 1863 , vol. 128, p. 168

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   149.6
  • LogP   0.7834
  • H_Acceptors   6
  • H_Donors   2
  • Rotatable_Bonds   3

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