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CS-W001157 4
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2,6-Dinitroterephthalic acid

  • CAS No. 69824-99-3

  • Cat. No. CS-0371829
  • Molecule weight256.13
  • Purity≥95%
  • MDL No.MFCD27938910

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

2,6-Dinitroterephthalic acid|CS-0371829

Structure of 69824-99-3

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General Information

  • CAS No. 69824-99-3
  • Cat. No. CS-0371829
  • Purity ≥95%
  • MDL No. MFCD27938910
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄N₂O₈
  • Molecular Weight 256.13
  • Synonym(s) 2,6-Dinitrobenzene-1,4-dicarboxylic acid
  • SMILES O=C(C1=CC([N+]([O-])=O)=C(C(O)=O)C([N+]([O-])=O)=C1)O

Synthesis

  • Route1

    References

    • Pound, Graham J.; Pletnev, Alexandre A.; Fang, Xiaomin; Pletneva, Ekaterina V. Chemical Communications, 2011 , vol. 47, # 20 p. 5714 - 5716
  • Route2
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    • In-stock
      2,6-Dinitroterephthalic acid|CS-0371829
      69824-99-3

    References

    • Wheeler; Harris Journal of the American Chemical Society, 1927 , vol. 49, p. 497
  • Route3
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    • In-stock
      2,6-Dinitroterephthalic acid|CS-0371829
      69824-99-3

    References

    • Haeussermann; Martz Chemische Berichte, 1893 , vol. 26, p. 2983 Chemische Berichte, 1895 , vol. 28, p. 81

Safety Information

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GHS Pictogram :
GHS No : GHS03
Signal Word : Danger
UN#: 1479
Class : 5.1
Packing Group : Ⅲ
Hazard Statements : H272-H315-H319
Precautionary Statements : P210-P220-P264-P280-P302+P352-P362-P370+P378-P501

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Computational Chemistry Data

  • TPSA   160.88
  • LogP   0.8994
  • H_Acceptors   6
  • H_Donors   2
  • Rotatable_Bonds   4

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