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CS-W001157 4
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6-Methyl-1H-indazole-3-carbonitrile

  • CAS No. 858227-54-0

  • Cat. No. CS-0367330
  • Molecule weight157.17
  • Purity≥98%
  • MDL No.None

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

6-Methyl-1H-indazole-3-carbonitrile|CS-0367330

Structure of 858227-54-0

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General Information

  • CAS No. 858227-54-0
  • Cat. No. CS-0367330
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇N₃
  • Molecular Weight 157.17
  • Synonym(s) 6-METHYL-3-INDAZOLECARBONITRILE
  • SMILES N#CC1C2C(NN=1)=CC(C)=CC=2

Synthesis

  • Route1
    • 2-(2-Amino-4-methylphenyl)acetonitrile|CS-1673301
      861068-42-0
    • ~%
    • 6-Methyl-1H-indazole-3-carbonitrile|CS-0367330
      858227-54-0

    References

    • Snyder; Williams Journal of the American Chemical Society, 1954 , vol. 76, p. 1298,1300
  • Route2
    • 2-(4-Methyl-2-nitrophenyl)acetonitrile|CS-0574204
      855938-47-5
    • ~%
    • 6-Methyl-1H-indazole-3-carbonitrile|CS-0367330
      858227-54-0

    References

    • Snyder; Williams Journal of the American Chemical Society, 1954 , vol. 76, p. 1298,1300

Safety Information

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

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Computational Chemistry Data

  • TPSA   52.47
  • LogP   1.743
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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