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CS-W001157 4
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Ethyl 3-bromo-4,6-dimethyl-2-oxo-2h-pyran-5-carboxylate

  • CAS No. 18152-79-9

  • Cat. No. CS-0298847
  • Purity≥98%
  • MDL No.None

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

Ethyl 3-bromo-4,6-dimethyl-2-oxo-2h-pyran-5-carboxylate|CS-0298847

Structure of 18152-79-9

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General Information

  • CAS No. 18152-79-9
  • Cat. No. CS-0298847
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrO₄
  • Molecular Weight 275.10
  • Synonym(s) 3-Bromo-5-carbethoxy-4,6-dimethyl-2-pyrone
  • SMILES CCOC(=O)C1=C(C)OC(=O)C(=C1C)Br

Synthesis

  • Route1
    • Ethyl 4,6-dimethyl-2-oxo-2h-pyran-5-carboxylate|CS-0216361
      3385-34-0
    • ~85%
    • Ethyl 3-bromo-4,6-dimethyl-2-oxo-2h-pyran-5-carboxylate|CS-0298847
      18152-79-9

    References

    • Al-Majid, Abdullah M. A.; Al-Othman, Zeid A.; Islam, Mohammad Shahidul Helvetica Chimica Acta, 2012 , vol. 95, # 2 p. 268 - 277
  • Route2

    References

    • Wilkins, Alistair L.; Lu, Yinrong; Tan, Seng-To Journal of Agricultural and Food Chemistry, 1995 , vol. 43, # 12 p. 3021 - 3025

Safety Information

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GHS Pictogram : N/A
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Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   56.51
  • LogP   2.19584
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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