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4-Methoxy-2-nitro-N-phenylaniline

  • CAS No. 5442-46-6

  • Cat. No. CS-0366640
  • Purity≥98%
  • MDL No.None

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

4-Methoxy-2-nitro-N-phenylaniline|CS-0366640

Structure of 5442-46-6

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General Information

  • CAS No. 5442-46-6
  • Cat. No. CS-0366640
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂N₂O₃
  • Molecular Weight 244.25
  • Synonym(s) 4-methoxy-2-nitro-N-phenyl-aniline
  • SMILES COC1=CC(=C(C=C1)NC2=CC=CC=C2)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Tietze, Mario; Iglesias, Alberto; Merisor, Elena; Conrad, Juergen; Klaiber, Iris; Beifuss, Uwe Organic Letters, 2005 , vol. 7, # 8 p. 1549 - 1552
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    • 4-Methoxy-2-nitro-N-phenylaniline|CS-0366640
      5442-46-6

    References

    • King; King; Muir Journal of the Chemical Society, 1946 , p. 5,8

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

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Computational Chemistry Data

  • TPSA   64.4
  • LogP   3.347
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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