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CS-W001157 4
Total: USD 88.00

4-Acetamido-3-ethoxynitrobenzene

  • CAS No. 116496-76-5

  • Cat. No. CS-0001856
  • Molecule weightNone
  • Purity≥98%
  • MDL No.MFCD00994990

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

4-Acetamido-3-ethoxynitrobenzene|CS-0001856

Structure of 116496-76-5

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General Information

  • CAS No. 116496-76-5
  • Cat. No. CS-0001856
  • Purity ≥98%
  • MDL No. MFCD00994990
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂N₂O₄
  • Molecular Weight None
  • Synonym(s) N-(2-ETHOXY-4-NITROPHENYL)ACETAMIDE
  • SMILES CCOC1=C(NC(C)=O)C=CC([N+]([O-])=O)=C1

Synthesis

  • Route1
    • null|null
      74-96-4
    • In-stock
      N-(2-Hydroxy-4-nitrophenyl)acetamide|CS-0001855
      25351-89-7
    • ~98%
    • In-stock
      4-Acetamido-3-ethoxynitrobenzene|CS-0001856
      116496-76-5

    References

    • Wyeth Patent: US2005/65181 A1, 2005 ; Location in patent: Page/Page column 3 ;
  • Route2
    • null|null
      121-88-0
    • ~%
    • In-stock
      4-Acetamido-3-ethoxynitrobenzene|CS-0001856
      116496-76-5

    References

    • Journal of Medicinal Chemistry, , vol. 48, # 4 p. 1107 - 1131
  • Route3
    • N-(2-ethoxyphenyl)acetamide|CS-0453866
      581-08-8
    • ~%
    • In-stock
      4-Acetamido-3-ethoxynitrobenzene|CS-0001856
      116496-76-5

    References

    • Chemische Berichte, , vol. 32, p. 160

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   81.47
  • LogP   1.9519
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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