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CS-W001157 4
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1-Bromo-5-(1,3-dioxolan-2-yl)-2-methoxybenzene

  • CAS No. 223418-72-2

  • Cat. No. CS-0193436
  • Molecule weight259.10
  • Purity95+%
  • MDL No.None

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

1-Bromo-5-(1,3-dioxolan-2-yl)-2-methoxybenzene|CS-0193436

Structure of 223418-72-2

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General Information

  • CAS No. 223418-72-2
  • Cat. No. CS-0193436
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrO₃
  • Molecular Weight 259.10
  • Synonym(s) 1,3-Dioxolane,2-(3-bromo-4-methoxyphenyl)
  • SMILES COC1=C(C=C(C=C1)C2OCCO2)Br

Synthesis

  • Route1
    • 2-Bromo-4-(1,3-dioxolan-2-yl)phenol|CS-0193334
      162271-15-0
    • null|null
      77-78-1
    • ~93%
    • 1-Bromo-5-(1,3-dioxolan-2-yl)-2-methoxybenzene|CS-0193436
      223418-72-2

    References

    • PURDUE RESEARCH FOUNDATION Patent: WO2008/76767 A1, 2008 ; Location in patent: Page/Page column 18; 30 ;
  • Route2

    References

    • Sanofi-Synthelabo Patent: US6673790 B1, 2004 ; US 6673790 B1
  • Route3

    References

    • Anson, Christopher E.; Creaser, Colin S.; Malkov, Andrej V.; Mojovic, Ljubica; Stephenson, G. Richard Journal of Organometallic Chemistry, 2003 , vol. 668, # 1-2 p. 101 - 122

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   27.69
  • LogP   2.5031
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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