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CS-W001157 4
Total: USD 88.00

3-Methyl-4-nitro-2H-indazole

  • CAS No. 945397-03-5

  • Cat. No. CS-0467335
  • Purity≥98%
  • MDL No.None

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

3-Methyl-4-nitro-2H-indazole|CS-0467335

Structure of 945397-03-5

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General Information

  • CAS No. 945397-03-5
  • Cat. No. CS-0467335
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇N₃O₂
  • Molecular Weight 177.16
  • Synonym(s) None
  • SMILES CC1=C2C(=NN1)C=CC=C2[N+](=O)[O-]

Synthesis

  • Route1

    References

    • ARRAY BIOPHARMA INC.; BOYS, Mark Laurence; DELISLE, Robert Kirk; HICKEN, Erik James; KENNEDY, April L.; MARESKA, David A.; MARMSATER, Fredrik P.; MUNSON, Mark C.; NEWHOUSE, Brad; RAST, Bryson; RIZZI, James P.; RODRIGUEZ, Martha E.; TOPALOV, George T.; ZHAO, Qian Patent: WO2012/82689 A1, 2012 ; Location in patent: Page/Page column 127-128 ; WO 2012/082689 A1
  • Route2

    References

    • ARRAY BIOPHARMA INC.; BOYS, Mark Laurence; DELISLE, Robert Kirk; HICKEN, Erik James; KENNEDY, April L.; MARESKA, David A.; MARMSATER, Fredrik P.; MUNSON, Mark C.; NEWHOUSE, Brad; RAST, Bryson; RIZZI, James P.; RODRIGUEZ, Martha E.; TOPALOV, George T.; ZHAO, Qian Patent: WO2012/82689 A1, 2012 ; WO 2012/082689 A1

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   71.82
  • LogP   1.77952
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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