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CS-W001157 4
Total: USD 88.00

2,3-Diamino-5-nitrobenzoic acid

  • CAS No. 98279-87-9

  • Cat. No. CS-0587143
  • Purity≥98%
  • MDL No.None

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

2,3-Diamino-5-nitrobenzoic acid|CS-0587143

Structure of 98279-87-9

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General Information

  • CAS No. 98279-87-9
  • Cat. No. CS-0587143
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇N₃O₄
  • Molecular Weight 197.15
  • Synonym(s) None
  • SMILES O=C(O)C1=CC([N+]([O-])=O)=CC(N)=C1N

Synthesis

  • Route1
    • 2-Amino-3,5-dinitrobenzoic acid|CS-0251476
      609-97-2
    • ~69%
    • 2,3-Diamino-5-nitrobenzoic acid|CS-0587143
      98279-87-9

    References

    • Zhou, Zhang-Lin; Kher, Sunil M.; Cai, Sui Xiong; Whittemore, Edward R.; Espitia, Stephen A.; Hawkinson, Jon E.; Tran, Minhtam; Woodward, Richard M.; Weber, Eckard; Keana, John F. W. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 8 p. 1769 - 1780
  • Route2
    • 2-Fluoro-3,5-dinitrobenzoic acid|CS-0251181
      445-65-8
    • ~%
    • 2,3-Diamino-5-nitrobenzoic acid|CS-0587143
      98279-87-9

    References

    • Zhou, Zhang-Lin; Kher, Sunil M.; Cai, Sui Xiong; Whittemore, Edward R.; Espitia, Stephen A.; Hawkinson, Jon E.; Tran, Minhtam; Woodward, Richard M.; Weber, Eckard; Keana, John F. W. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 8 p. 1769 - 1780
  • Route3

    References

    • Zhou, Zhang-Lin; Kher, Sunil M.; Cai, Sui Xiong; Whittemore, Edward R.; Espitia, Stephen A.; Hawkinson, Jon E.; Tran, Minhtam; Woodward, Richard M.; Weber, Eckard; Keana, John F. W. Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 8 p. 1769 - 1780

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   132.48
  • LogP   0.4574
  • H_Acceptors   5
  • H_Donors   3
  • Rotatable_Bonds   2

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