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CS-W001157 4
Total: USD 88.00

4-[(4-nitrophenyl)amino]butanoic acid

  • CAS No. 87962-89-8

  • Cat. No. CS-0234235
  • Purity≥95%
  • MDL No.None

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

4-[(4-nitrophenyl)amino]butanoic acid|CS-0234235

Structure of 87962-89-8

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General Information

  • CAS No. 87962-89-8
  • Cat. No. CS-0234235
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂N₂O₄
  • Molecular Weight 224.21
  • Synonym(s) 4-(4-nitroanilino)butanoic acid
  • SMILES O=C(O)CCCNC1=CC=C([N+]([O-])=O)C=C1

Synthesis

  • Route1
    • 1-(4-Nitrophenyl)pyrrolidin-2-one|CS-0198921
      13691-26-4
    • ~%
    • 4-[(4-nitrophenyl)amino]butanoic acid|CS-0234235
      87962-89-8

    References

    • Reppe et al. Justus Liebigs Annalen der Chemie, 1955 , vol. 596, p. 1,216
  • Route2

    References

    • Abdallah, Jassim M.; Moodie, Roy B. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1983 , p. 1243 - 1250

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   92.47
  • LogP   1.8715
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   6

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