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CS-W001157 4
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2-Bromo-1-(2-(4-chlorophenyl)-4-methylthiazol-5-yl)ethan-1-one

  • CAS No. 54001-36-4

  • Cat. No. CS-0549307
  • Purity≥98%
  • MDL No.None

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

2-Bromo-1-(2-(4-chlorophenyl)-4-methylthiazol-5-yl)ethan-1-one|CS-0549307

Structure of 54001-36-4

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General Information

  • CAS No. 54001-36-4
  • Cat. No. CS-0549307
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₉BrClNOS
  • Molecular Weight 330.63
  • Synonym(s) 2-Bromo-1-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]-1-ethanone
  • SMILES CC1=C(SC(=N1)C2=CC=C(C=C2)Cl)C(=O)CBr

Synthesis

  • Route1
    • 1-(2-(4-Chlorophenyl)-4-methylthiazol-5-yl)ethan-1-one|CS-0279487
      54001-07-9
    • ~68%
    • 2-Bromo-1-(2-(4-chlorophenyl)-4-methylthiazol-5-yl)ethan-1-one|CS-0549307
      54001-36-4

    References

    • Bhingolikar; Ingle; Dengle; Bondge; Mane Journal of the Indian Chemical Society, 2002 , vol. 79, # 8 p. 703 - 704
  • Route2

    References

    • Sawhney,S.N.; Arora,S.K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1976 , vol. 14, p. 552 - 555
  • Route3
    • null|null
      54001-29-5
    • ~%
    • 2-Bromo-1-(2-(4-chlorophenyl)-4-methylthiazol-5-yl)ethan-1-one|CS-0549307
      54001-36-4

    References

    • Csavassy,G.; Gyoerfi,Z.A. Justus Liebigs Annalen der Chemie, 1974 , p. 1195 - 1205

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   29.96
  • LogP   4.34952
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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