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CS-W001157 4
Total: USD 88.00

4-Cyano-N,N-dimethylbenzenesulfonamide

  • CAS No. 63877-94-1

  • Cat. No. CS-0008769
  • Purity≥98%
  • MDL No.MFCD00510133

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

4-Cyano-N,N-dimethylbenzenesulfonamide|CS-0008769

Structure of 63877-94-1

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General Information

  • CAS No. 63877-94-1
  • Cat. No. CS-0008769
  • Purity ≥98%
  • MDL No. MFCD00510133
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O₂S
  • Molecular Weight 210.25
  • Synonym(s) None
  • SMILES CN(C)S(C1=CC=C(C#N)C=C1)(=O)=O

Synthesis

  • Route1
    • null|null
      124-40-3
    • In-stock
      4-Cyanobenzenesulfonyl chloride|CS-0072131
      49584-26-1
    • ~96%
    • In-stock
      4-Cyano-N,N-dimethylbenzenesulfonamide|CS-0008769
      63877-94-1

    References

    • Watterson, Scott H.; Chen, Ping; Zhao, Yufen; Gu, Henry H.; Dhar, T. G. Murali; Xiao, Zili; Ballentine, Shelley K.; Shen, Zhongqi; Fleener, Catherine A.; Rouleau, Katherine A.; Obermeier, Mary; Yang, Zheng; McIntyre, Kim W.; Shuster, David J.; Witmer, Mark; Dambach, Donna; Chao, Sam; Mathur, Arvind; Chen, Bang-Chi; Barrish, Joel C.; Robl, Jeffrey A.; Townsend, Robert; Iwanowicz, Edwin J. Journal of Medicinal Chemistry, 2007 , vol. 50, # 15 p. 3730 - 3742
  • Route2
    • 4-Chloro-N,N-dimethylbenzenesulfonamide|CS-0524099
      7463-22-1
    • ~%
    • In-stock
      4-Cyano-N,N-dimethylbenzenesulfonamide|CS-0008769
      63877-94-1

    References

    • Eliel; Nelson Journal of Organic Chemistry, 1955 , vol. 20, p. 1657,1661
  • Route3
    • null|null
      143-33-9
    • ~%
    • In-stock
      4-Cyano-N,N-dimethylbenzenesulfonamide|CS-0008769
      63877-94-1

    References

    • Andrewes; King; Walker Pr.roy.Soc.<B>, 1946 , vol. 133, p. 20,36

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   61.17
  • LogP   0.80858
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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