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CS-W001157 4
Total: USD 88.00

8-Bromo-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde

  • CAS No. 860003-88-9

  • Cat. No. CS-0247846
  • Purity≥97%
  • MDL No.MFCD07364381

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

8-Bromo-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde|CS-0247846

Structure of 860003-88-9

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General Information

  • CAS No. 860003-88-9
  • Cat. No. CS-0247846
  • Purity ≥97%
  • MDL No. MFCD07364381
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrO₃
  • Molecular Weight 243.06
  • Synonym(s) UKRORGSYN-BB BBV-2086991
  • SMILES O=CC1=CC(Br)=C(OCCO2)C2=C1

Synthesis

  • Route1
    • In-stock
      3-Bromo-4,5-dihydroxybenzaldehyde|CS-0103468
      16414-34-9
    • null|null
      106-93-4
    • ~96%
    • In-stock
      8-Bromo-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde|CS-0247846
      860003-88-9

    References

    • Roche Palo Alto LLC Patent: US2007/49609 A1, 2007 ; Location in patent: Page/Page column 101 ; US 20070049609 A1
  • Route2
    • null|null
      106-93-4
    • ~74%
    • In-stock
      8-Bromo-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde|CS-0247846
      860003-88-9

    References

    • GLAXO GROUP LIMITED Patent: WO2007/122258 A1, 2007 ; Location in patent: Page/Page column 45 ;
  • Route3

    References

    • Vallejos, Gabriel; Fierro, Angelica; Rezende, Marcos Caroli; Sepulveda-Boza, Silvia; Reyes-Parada, Miguel Bioorganic and Medicinal Chemistry, 2005 , vol. 13, # 14 p. 4450 - 4457

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

Quality Control

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.0328
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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