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CS-W001157 4
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4-(Methylsulfanyl)butanenitrile

  • CAS No. 59121-24-3

  • Cat. No. CS-0240117
  • Molecule weight115.20
  • Purity≥98%
  • MDL No.None

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

4-(Methylsulfanyl)butanenitrile|CS-0240117

Structure of 59121-24-3

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General Information

  • CAS No. 59121-24-3
  • Cat. No. CS-0240117
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₉NS
  • Molecular Weight 115.20
  • Synonym(s) Butanenitrile, 4-(methylthio)-
  • SMILES CSCCCC#N

Synthesis

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    References

    • Auriga International; Dubois, Jacques; Marchal, Alfred; Lacroix, Damien; Cabou, Jérôme Patent: US2013/142739 A1, 2013 ; Location in patent: Paragraph 0074-0088 ;
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    References

    • Martell, Jeffrey D.; Li, Huiying; Doukov, Tzanko; Martasek, Pavel; Roman, Linda J.; Soltis, Michael; Poulos, Thomas L.; Silverman, Richard B. Journal of the American Chemical Society, 2010 , vol. 132, # 2 p. 798 - 806
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    References

    • US5775329 A1, ;

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

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   1.65318
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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