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CS-W001157 4
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Sodium 4-nitrobenzoate

  • CAS No. 3847-57-2

  • Cat. No. CS-0187638
  • Purity≥97%
  • MDL No.MFCD00797416

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

Sodium 4-nitrobenzoate|CS-0187638

Structure of 3847-57-2

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General Information

  • CAS No. 3847-57-2
  • Cat. No. CS-0187638
  • Purity ≥97%
  • MDL No. MFCD00797416
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄NNaO₄
  • Molecular Weight 189.10
  • Synonym(s) None
  • SMILES O=[N+]([O-])C1=CC=C(C(O[Na])=O)C=C1

Synthesis

  • Route1

    References

    • Horn, Markus; Mayr, Herbert Chemistry - A European Journal, 2010 , vol. 16, # 25 p. 7469 - 7477
  • Route2

    References

    • Radhakrishnamurti, P. S.; Misra, P. C. Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical & Analytical, 1980 , vol. 19, # 5 p. 427 - 430
  • Route3
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      19614-29-0
    • ~%
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      151-56-4
    • Sodium 4-nitrobenzoate|CS-0187638
      3847-57-2

    References

    • Slebocka-Tilk, H.; Brown, R. S. Journal of Organic Chemistry, 1987 , vol. 52, # 5 p. 805 - 808

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   0.8351
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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