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CS-W001157 4
Total: USD 88.00

2-Methoxy-4,6-dinitrobenzoic acid

  • CAS No. 95192-63-5

  • Cat. No. CS-0321654
  • Molecule weight242.14
  • Purity≥98%
  • MDL No.None

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

2-Methoxy-4,6-dinitrobenzoic acid|CS-0321654

Structure of 95192-63-5

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General Information

  • CAS No. 95192-63-5
  • Cat. No. CS-0321654
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆N₂O₇
  • Molecular Weight 242.14
  • Synonym(s) None
  • SMILES O=C(O)C1=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C1OC

Synthesis

  • Route1
    • null|null
      15012-38-1
    • null|null
      124-41-4
    • ~35%
    • 4-Methoxy-2,6-dinitrobenzoic acid|CS-0321655
      95192-59-9
    • 2-Methoxy-4,6-dinitrobenzoic acid|CS-0321654
      95192-63-5

    References

    • Samet, Alexander V.; Marshalkin, Victor N.; Kislyi, Konstantine A.; Chernysheva, Natalya B.; Strelenko, Yuri A.; Semenov, Victor V. Journal of Organic Chemistry, 2005 , vol. 70, # 23 p. 9371 - 9376
  • Route2
    • 1-Methoxy-2-methyl-3,5-dinitrobenzene|CS-0210503
      95192-65-7
    • ~4%
    • null|null
      65841-03-4
    • 2-Methoxy-4,6-dinitrobenzoic acid|CS-0321654
      95192-63-5

    References

    • Segura, Pascual; Bunnett, Joseph F.; Villanova, Laura Journal of Organic Chemistry, 1985 , vol. 50, # 7 p. 1041 - 1045

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   132.81
  • LogP   1.2098
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   4

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