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CS-W001157 4
Total: USD 88.00

1-Methyl-6-nitro-1H-indole

  • CAS No. 99459-48-0

  • Cat. No. CS-0151166
  • Purity≥98%
  • MDL No.MFCD13178347

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

1-Methyl-6-nitro-1H-indole|CS-0151166

Structure of 99459-48-0

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General Information

  • CAS No. 99459-48-0
  • Cat. No. CS-0151166
  • Purity ≥98%
  • MDL No. MFCD13178347
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂
  • Molecular Weight 176.17
  • Synonym(s) 1-Methyl-6-nitro-indol
  • SMILES CN1C=CC2=C1C=C(C=C2)[N+](=O)[O-]

Synthesis

  • Route1
    • In-stock
      6-Nitroindole|CS-W001576
      4769-96-4
    • null|null
      74-88-4
    • ~98%
    • In-stock
      1-Methyl-6-nitro-1H-indole|CS-0151166
      99459-48-0

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH Patent: WO2009/16119 A1, 2009 ; Location in patent: Page/Page column 65 ; WO 2009/016119 A1
  • Route2

    References

    • Hoffmann-La Roche Inc. Patent: US6228877 B1, 2001 ;
  • Route3
    • In-stock
      6-Nitroindole|CS-W001576
      4769-96-4
    • null|null
      616-38-6
    • ~94%
    • In-stock
      1-Methyl-6-nitro-1H-indole|CS-0151166
      99459-48-0

    References

    • Hoffmann-La Roche Inc. Patent: US6326501 B1, 2001 ;

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-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   48.07
  • LogP   2.0865
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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