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1-Methyl-3-nitro-1H-indole

  • CAS No. 36728-89-9

  • Cat. No. CS-0161789
  • Molecule weight176.17
  • Purity≥98%
  • MDL No.MFCD13178597

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

1-Methyl-3-nitro-1H-indole|CS-0161789

Structure of 36728-89-9

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General Information

  • CAS No. 36728-89-9
  • Cat. No. CS-0161789
  • Purity ≥98%
  • MDL No. MFCD13178597
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂
  • Molecular Weight 176.17
  • Synonym(s) 3-Nitro-1-methylindole
  • SMILES O=[N+](C1=CN(C)C2=C1C=CC=C2)[O-]

Synthesis

  • Route1

    References

    • Pelkey; Gribble Synthesis, 1999 , # 7 p. 1117 - 1122
  • Route2

    References

    • Roy, Sujata; Gribble, Gordon W. Heterocycles, 2006 , vol. 70, p. 51 - 56

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-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-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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