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CS-W001157 4
Total: USD 88.00

1-Methyl-4-nitro-1H-indole

  • CAS No. 91482-63-2

  • Cat. No. CS-0061754
  • Purity≥97%
  • MDL No.MFCD08236728

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

1-Methyl-4-nitro-1H-indole|CS-0061754

Structure of 91482-63-2

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General Information

  • CAS No. 91482-63-2
  • Cat. No. CS-0061754
  • Purity ≥97%
  • MDL No. MFCD08236728
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂
  • Molecular Weight 176.17
  • Synonym(s) 1-methyl-4-nitroindole
  • SMILES O=[N+](C1=CC=CC2=C1C=CN2C)[O-]

Synthesis

  • Route1
    • In-stock
      4-Nitroindole|CS-D0681
      4769-97-5
    • null|null
      74-88-4
    • ~97%
    • In-stock
      1-Methyl-4-nitro-1H-indole|CS-0061754
      91482-63-2

    References

    • Ple, Patrick A.; Green, Tim P.; Hennequin, Laurent F.; Curwen, Jon; Fennell, Michael; Allen, Jack; Lambert-Van Der Brempt, Christine; Costello, Gerard Journal of Medicinal Chemistry, 2004 , vol. 47, # 4 p. 871 - 887
  • Route2

    References

    • Hoffmann-La Roche Inc. Patent: US6326501 B1, 2001 ;
  • Route3

    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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-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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