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CS-W001157 4
Total: USD 88.00

2-(Benzhydrylthio)acetic acid

  • CAS No. 63547-22-8

  • Cat. No. CS-0008363
  • Purity≥98%
  • MDL No.MFCD05262040

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

2-(Benzhydrylthio)acetic acid|CS-0008363

Structure of 63547-22-8

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General Information

  • CAS No. 63547-22-8
  • Cat. No. CS-0008363
  • Purity ≥98%
  • MDL No. MFCD05262040
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₂S
  • Molecular Weight 258.34
  • Synonym(s) Diphenyl methyl thioacetic acid
  • SMILES O=C(O)CSC(C1=CC=CC=C1)C2=CC=CC=C2

Synthesis

  • Route1
    • Diphenylmethanol Diphenhydramine Impurity|CS-0229778
      91-01-0
    • null|null
      68-11-1
    • ~99%
    • In-stock
      2-(Benzhydrylthio)acetic acid|CS-0008363
      63547-22-8

    References

    • Carceller, Elena; Merlos, Manuel; Giral, Marta; Almansa, Carmen; Bartroli, Javier; et al. Journal of Medicinal Chemistry, 1993 , vol. 36, # 20 p. 2984 - 2997
  • Route2
    • null|null
      79-11-8
    • ~%
    • In-stock
      2-(Benzhydrylthio)acetic acid|CS-0008363
      63547-22-8

    References

    • WO2007/71035 A1, ; Page/Page column 24 ; WO 2007/071035 A1
  • Route3
    • In-stock
      Thioglycolate sodium|CS-0197966
      367-51-1
    • null|null
      776-74-9
    • ~46%
    • In-stock
      2-(Benzhydrylthio)acetic acid|CS-0008363
      63547-22-8

    References

    • KANDULA, Mahesh Patent: WO2013/179153 A1, 2013 ; Location in patent: Paragraph 0095-0097 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.5938
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   5

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