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CS-W001157 4
Total: USD 88.00

3-(4-Methylbenzenesulfonyl)propanenitrile

  • CAS No. 10154-80-0

  • Cat. No. CS-0219443
  • Purity95+%
  • MDL No.None

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

3-(4-Methylbenzenesulfonyl)propanenitrile|CS-0219443

Structure of 10154-80-0

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General Information

  • CAS No. 10154-80-0
  • Cat. No. CS-0219443
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO₂S
  • Molecular Weight 209.26
  • Synonym(s) 3-(Toluene-4-sulfonyl)-propionitrile
  • SMILES CC1=CC=C(C=C1)S(=O)(=O)CCC#N

Synthesis

  • Route1
    • null|null
      824-79-3
    • null|null
      107-13-1
    • ~80%
    • 3-(4-Methylbenzenesulfonyl)propanenitrile|CS-0219443
      10154-80-0

    References

    • Bulletin of the Chemical Society of Japan, , vol. 53, # 11 p. 3379 - 3380
  • Route2
    • 3-[(4-Methylphenyl)thio]propanenitrile|CS-0071985
      5331-06-6
    • ~%
    • 3-(4-Methylbenzenesulfonyl)propanenitrile|CS-0219443
      10154-80-0

    References

    • Journal of the American Chemical Society, , vol. 69, p. 2328,2330
  • Route3
    • null|null
      106-45-6
    • ~%
    • 3-(4-Methylbenzenesulfonyl)propanenitrile|CS-0219443
      10154-80-0

    References

    • Journal of the American Chemical Society, , vol. 69, p. 2328,2330

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.93
  • LogP   1.6824
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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