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CS-W001157 4
Total: USD 88.00

3-(1h-1,2,4-Triazol-1-yl)propanenitrile

  • CAS No. 76686-83-4

  • Cat. No. CS-0244614
  • Purity≥97%
  • MDL No.None

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

3-(1h-1,2,4-Triazol-1-yl)propanenitrile|CS-0244614

Structure of 76686-83-4

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General Information

  • CAS No. 76686-83-4
  • Cat. No. CS-0244614
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₆N₄
  • Molecular Weight 122.13
  • Synonym(s) 1H-1,2,4-Triazole-1-propanenitrile(9CI)
  • SMILES N#CCCN1N=CN=C1

Synthesis

  • Route1

    References

    • Ai, Xin; Wang, Xin; Liu, Jin-Ming; Ge, Ze-Mei; Cheng, Tie-Ming; Li, Run-Tao Tetrahedron, 2010 , vol. 66, # 29 p. 5373 - 5377

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

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Computational Chemistry Data

  • TPSA   54.5
  • LogP   0.19178
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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