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1-(5-Bromothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione

  • CAS No. 326-71-6

  • Cat. No. CS-0516431
  • Molecule weight301.08
  • Purity≥98%
  • MDL No.None

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

1-(5-Bromothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione|CS-0516431

Structure of 326-71-6

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General Information

  • CAS No. 326-71-6
  • Cat. No. CS-0516431
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄BrF₃O₂S
  • Molecular Weight 301.08
  • Synonym(s) 1-(5-BROMO-2-THIENYL)-4,4,4-TRIFLUORO-1,3-BUTANEDIONE
  • SMILES O=C(C1=CC=C(Br)S1)CC(C(F)(F)F)=O

Synthesis

  • Route1

    References

    • Freund, Christelle; Porzio, William; Giovanella, Umberto; Vignali, Francesco; Pasini, Mariacecilia; Destri, Silvia; Mech, Agnieszka; Di Pietro, Sebastiano; Di Bari, Lorenzo; Mineo, Placido Inorganic Chemistry, 2011 , vol. 50, # 12 p. 5417 - 5429
  • Route2
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    • 1-(5-Bromothiophen-2-yl)-4,4,4-trifluorobutane-1,3-dione|CS-0516431
      326-71-6

    References

    • Barkley; Levine Journal of the American Chemical Society, 1951 , vol. 73, p. 4625

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   3.2148
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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