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5-Acetamido-2-nitrobenzoic acid

  • CAS No. 4368-83-6

  • Cat. No. CS-0206051
  • Molecule weight224.17
  • Purity≥98%
  • MDL No.MFCD00035889

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

5-Acetamido-2-nitrobenzoic acid|CS-0206051

Structure of 4368-83-6

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General Information

  • CAS No. 4368-83-6
  • Cat. No. CS-0206051
  • Purity ≥98%
  • MDL No. MFCD00035889
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₅
  • Molecular Weight 224.17
  • Synonym(s) 3'-Carboxy-4'-nitroacetanilide
  • SMILES O=C(O)C1=CC(=CC=C1N(=O)=O)NC(=O)C

Synthesis

  • Route1

    References

    • Nekhoroshev, A. A.; Sevbo, D. P.; Ginzburg, O. A. Journal of Organic Chemistry USSR (English Translation), 1981 , vol. 17, # 2 p. 313 - 317 Zhurnal Organicheskoi Khimii, 1981 , vol. 17, # 2 p. 369 - 374
  • Route2
    • N-(3-Methyl-4-nitrophenyl)acetamide|CS-0062475
      51366-39-3
    • ~%
    • 5-Acetamido-2-nitrobenzoic acid|CS-0206051
      4368-83-6

    References

    • Kalb et al. Chemische Berichte, 1926 , vol. 59, p. 1864
  • Route3
    • null|null
      104155-86-4
    • ~%
    • 5-Acetamido-2-nitrobenzoic acid|CS-0206051
      4368-83-6

    References

    • Friedlaender; Fritsch Monatshefte fuer Chemie, 1903 , vol. 24, p. 8

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   109.54
  • LogP   1.2514
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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