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4-Nitroindolin-2-one

  • CAS No. 61394-51-2

  • Cat. No. CS-0050793
  • Molecule weight178.14
  • Purity≥96%
  • MDL No.MFCD09835635

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

4-Nitroindolin-2-one|CS-0050793

Structure of 61394-51-2

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General Information

  • CAS No. 61394-51-2
  • Cat. No. CS-0050793
  • Purity ≥96%
  • MDL No. MFCD09835635
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆N₂O₃
  • Molecular Weight 178.14
  • Synonym(s) 4-Nitro-1,3-dihydro-2H-indol-2-one
  • SMILES O=C1NC2=C(C([N+]([O-])=O)=CC=C2)C1

Synthesis

  • Route1

    References

    • MERCK and CO., INC. Patent: WO2007/61692 A2, 2007 ; Location in patent: Page/Page column 91 ; WO 2007/061692 A2
  • Route2
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    • ~%
    • In-stock
      4-Nitroindolin-2-one|CS-0050793
      61394-51-2

    References

    • SCHERING AKTIENGESELLSCHAFT Patent: WO2005/34939 A1, 2005 ; Location in patent: Page/Page column 74 ;

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-H317-H319-H335-H412
Precautionary Statements : P261-P273-P280

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Computational Chemistry Data

  • TPSA   72.24
  • LogP   1.0894
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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