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CS-W001157 4
Total: USD 88.00

3-[(2-cyanoethyl)(phenyl)amino]propanenitrile

  • CAS No. 1555-66-4

  • Cat. No. CS-0217123
  • Molecule weight199.25
  • Purity95+%
  • MDL No.None

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

3-[(2-cyanoethyl)(phenyl)amino]propanenitrile|CS-0217123

Structure of 1555-66-4

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General Information

  • CAS No. 1555-66-4
  • Cat. No. CS-0217123
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃N₃
  • Molecular Weight 199.25
  • Synonym(s) N,N-Dicyanoethylaniline
  • SMILES C1=CC=C(C=C1)N(CCC#N)CCC#N

Synthesis

  • Route1
    • null|null
      107-13-1
    • null|null
      74497-02-2
    • ~%
    • 3-[(2-cyanoethyl)(phenyl)amino]propanenitrile|CS-0217123
      1555-66-4

    References

    • Journal of the American Chemical Society, , vol. 74, p. 1096
  • Route2
    • null|null
      107-13-1
    • null|null
      74497-02-2
    • ~%
    • 3-[(2-cyanoethyl)(phenyl)amino]propanenitrile|CS-0217123
      1555-66-4
    • 2-(Phenylamino)propanenitrile|CS-0154985
      2182-39-0

    References

    • Journal of the Chemical Society, , p. 67,71
  • Route3

    References

    • Journal of the Chemical Society, , p. 1536,1542

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-P305+P351+P338-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   50.82
  • LogP   2.32036
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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