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CS-W001157 4
Total: USD 88.00

5-(4-Methoxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione

  • CAS No. 15795-54-7

  • Cat. No. CS-0360582
  • Molecule weight262.26
  • Purity≥97%
  • MDL No.None

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

5-(4-Methoxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione|CS-0360582

Structure of 15795-54-7

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General Information

  • CAS No. 15795-54-7
  • Cat. No. CS-0360582
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₄O₅
  • Molecular Weight 262.26
  • Synonym(s) 5-[(4-METHOXYPHENYL)METHYLENE]-2,2-DIMETHYL-1,3-DIOXANE-4,6-DIONE
  • SMILES CC1(C)OC(=O)C(=CC2=CC=C(C=C2)OC)C(=O)O1

Synthesis

  • Route1

    References

    • Khurana, Jitender M.; Vij, Kanika Tetrahedron Letters, 2011 , vol. 52, # 28 p. 3666 - 3669
  • Route2

    References

    • Kumar, Dhruva; Suresh; Sandhu, Jagir S. Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2013 , vol. 52, # 8 p. 1157 - 1160
  • Route3
    • 4-Methoxybenzaldehyde, ≥ 99% GC|CS-0676496
      123-11-5
    • null|null
      121072-18-2
    • ~20%
    • 5-(4-Methoxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione|CS-0360582
      15795-54-7

    References

    • Ogawa, Takuji; Murafuji, Toshihiro; Suzuki, Hitomi Chemistry Letters, 1988 , # 5 p. 849 - 852

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   61.83
  • LogP   1.9147
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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