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CS-W001157 4
Total: USD 88.00

S-Phenyl 4-methylbenzenesulfonothioate

  • CAS No. 3541-14-8

  • Cat. No. CS-0059968
  • Purity≥97%
  • MDL No.None

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

S-Phenyl 4-methylbenzenesulfonothioate|CS-0059968

Structure of 3541-14-8

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General Information

  • CAS No. 3541-14-8
  • Cat. No. CS-0059968
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂O₂S₂
  • Molecular Weight 264.36
  • Synonym(s) Toluene-4-thiosulfonic acid,S-phenyl ester
  • SMILES C=1(S(SC2=CC=CC=C2)(=O)=O)C=CC(C)=CC1

Synthesis

  • Route1
    • 1-(Phenylthio)pyrrolidine-2,5-dione|CS-1635338
      14204-24-1
    • null|null
      824-79-3
    • ~93%
    • S-Phenyl 4-methylbenzenesulfonothioate|CS-0059968
      3541-14-8

    References

    • Liang, Gaigai; Chen, Jing; Chen, Jiali; Li, Wanmei; Chen, Jiuxi; Wu, Huayue Tetrahedron Letters, 2012 , vol. 53, # 50 p. 6768 - 6770
  • Route2
    • null|null
      108-98-5
    • null|null
      1576-35-8
    • ~58%
    • S-Phenyl 4-methylbenzenesulfonothioate|CS-0059968
      3541-14-8

    References

    • Saravanan, Perumal; Anbarasan, Pazhamalai Organic Letters, 2014 , vol. 16, # 3 p. 848 - 851
  • Route3

    References

    • Marr, Felix; Froehlich, Roland; Hoppe, Dieter Tetrahedron Asymmetry, 2002 , vol. 13, # 23 p. 2587 - 2592

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   34.14
  • LogP   3.47602
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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