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CS-W001157 4
Total: USD 88.00

4-(Methylthio)benzonitrile

  • CAS No. 21382-98-9

  • Cat. No. CS-0008336
  • Purity≥98%
  • MDL No.MFCD00010381

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

4-(Methylthio)benzonitrile|CS-0008336

Structure of 21382-98-9

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General Information

  • CAS No. 21382-98-9
  • Cat. No. CS-0008336
  • Purity ≥98%
  • MDL No. MFCD00010381
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NS
  • Molecular Weight 149.21
  • Synonym(s) 1-Cyano-4-(methylthio)benzene; 4-Cyanothioanisole~4-(Methylmercapto)benzonitrile
  • SMILES N#CC1=CC=C(SC)C=C1

Description

Surface-enhanced Raman scattering of 4-(methylthio)benzonitrile adsorbed on silver surface has been investigated.4-(Methylthio)benzonitrile was used in the preparation of 4-cyanobenzenethiol.

Synthesis

  • Route1

    References

    • Joseph, P.J. Amal; Priyadarshini; Kantam, M. Lakshmi; Sreedhar Tetrahedron, 2013 , vol. 69, # 38 p. 8276 - 8283
  • Route2

    References

    • Koshima, Hideko; Hamada, Mitsuo; Tani, Makiko; Iwasaki, Shunsuke; Sato, Fumika Heterocycles, 2002 , vol. 57, # 11 p. 2145 - 2148
  • Route3
    • null|null
      60958-04-5
    • ~96%
    • In-stock
      4-(Methylthio)benzonitrile|CS-0008336
      21382-98-9

    References

    • Garcia, Nuria; Garcia-Garcia, Patricia; Fernandez-Rodriguez, Manuel A.; Garcia, Daniel; Pedrosa, Maria R.; Arnaiz, Francisco J.; Sanz, Roberto Green Chemistry, 2013 , vol. 15, # 4 p. 999 - 1005

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+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.28018
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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