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2-Phenoxyaniline Nimesulide Impurity

  • CAS No. 2688-84-8

  • Cat. No. CS-0229591
  • Purity≥98%
  • MDL No.MFCD00035765

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

2-Phenoxyaniline Nimesulide Impurity|CS-0229591

Structure of 2688-84-8

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General Information

  • CAS No. 2688-84-8
  • Cat. No. CS-0229591
  • Purity ≥98%
  • MDL No. MFCD00035765
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO
  • Molecular Weight 185.23
  • Synonym(s) None
  • SMILES O(C=1C=CC=CC1)C=2C=CC=CC2N

Synthesis

  • Route1
    • 1-Nitro-2-phenoxybenzene|CS-0214719
      2216-12-8
    • ~10%
    • 2-Phenoxyaniline Nimesulide Impurity|CS-0229591
      2688-84-8

    References

    • Beadle, James R.; Korzeniowsky, Stephen H.; Rosenberg, David E.; Garcia-Slanga, Blanche J.; Gokel, George W. Journal of Organic Chemistry, 1984 , vol. 49, # 9 p. 1594 - 1603
  • Route2
    • null|null
      39145-48-7
    • ~%
    • 2-Phenoxyaniline Nimesulide Impurity|CS-0229591
      2688-84-8

    References

    • Hoechst Aktiengesellschaft Patent: US4056522 A1, 1977 ;
  • Route3
    • null|null
      88-73-3
    • ~%
    • 2-Phenoxyaniline Nimesulide Impurity|CS-0229591
      2688-84-8

    References

    • Shibata; Das; Harada; Takeuchi; Bando Synlett, 2001 , # 11 p. 1755 - 1758

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302+H312+H332-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   35.25
  • LogP   3.0611
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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