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CS-W001157 4
Total: USD 88.00

1-Methyl-5-nitro-1H-indole

  • CAS No. 29906-67-0

  • Cat. No. CS-W021357
  • Purity≥97%
  • MDL No.MFCD07772841

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

1-Methyl-5-nitro-1H-indole|CS-W021357

Structure of 29906-67-0

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General Information

  • CAS No. 29906-67-0
  • Cat. No. CS-W021357
  • Purity ≥97%
  • MDL No. MFCD07772841
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂
  • Molecular Weight None
  • Synonym(s) 1-Methyl-5-Nitroindole; 1-Methyl-5-nitro-1H-indole
  • SMILES C2=CC1=C(C=CC(=C1)[N+]([O-])=O)[N]2C

Synthesis

  • Route1
    • null|null
      74-88-4
    • ~%
    • In-stock
      1-Methyl-5-nitro-1H-indole|CS-W021357
      29906-67-0

    References

    • WO2006/40520 A1, ; Page/Page column 124-125 ; WO 2006/040520 A1
  • Route2
    • In-stock
      5-Nitroindole|CS-D1052
      6146-52-7
    • null|null
      74-88-4
    • ~99%
    • In-stock
      1-Methyl-5-nitro-1H-indole|CS-W021357
      29906-67-0

    References

    • The United States of America, as represented by the Secretary, Department of Health and Human Services; Science Applications International Corporation (SAIC); Albany Molecular Research, Inc. Patent: WO2009/42907 A1, 2009 ; Location in patent: Page/Page column 36 ; WO 2009/042907 A1
  • Route3

    References

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

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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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