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CS-W001157 4
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1-(4-Bromothiophen-2-yl)-2-methylpropan-1-one

  • CAS No. 99769-26-3

  • Cat. No. CS-0550271
  • Molecule weight233.13
  • Purity≥98%
  • MDL No.None

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

1-(4-Bromothiophen-2-yl)-2-methylpropan-1-one|CS-0550271

Structure of 99769-26-3

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General Information

  • CAS No. 99769-26-3
  • Cat. No. CS-0550271
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉BrOS
  • Molecular Weight 233.13
  • Synonym(s) None
  • SMILES CC(C)C(=O)C1=CC(=CS1)Br

Synthesis

  • Route1
    • 2-Methyl-1-(thiophen-2-yl)propan-1-one|CS-0234223
      36448-60-9
    • ~39%
    • 1-(4-Bromothiophen-2-yl)-2-methylpropan-1-one|CS-0550271
      99769-26-3

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2008/118724 A1, 2008 ; Location in patent: Page/Page column 172 ; WO 2008/118724 A1

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   17.07
  • LogP   3.3493
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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