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CS-W001157 4
Total: USD 88.00

1,2,4-Triacetoxybenzene

  • CAS No. 613-03-6

  • Cat. No. CS-0199182
  • Purity≥98%
  • MDL No.MFCD00008700

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

1,2,4-Triacetoxybenzene|CS-0199182

Structure of 613-03-6

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General Information

  • CAS No. 613-03-6
  • Cat. No. CS-0199182
  • Purity ≥98%
  • MDL No. MFCD00008700
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂O₆
  • Molecular Weight 252.22
  • Synonym(s) benzene-1,2,4-triyl triacetate
  • SMILES CC(=O)OC1=CC(=C(C=C1)OC(=O)C)OC(=O)C

Description

1,2,4-Triacetoxybenzene can be used as a starting material:To prepare aminated hydroxynaphthazarins, echinamines A and B.To synthesize 6,7-dihydroxychromenones, which are further used to prepare various crown ethers.In the total synthesis of natural product santalin Y.

Synthesis

  • Route1
    • null|null
      108-24-7
    • null|null
      301849-82-1
    • ~60%
    • In-stock
      1,2,4-Triacetoxybenzene|CS-0199182
      613-03-6

    References

    • Adam, Waldemar; Balci, Metin; Kilic, Hamdullah Journal of Organic Chemistry, 2000 , vol. 65, # 19 p. 5926 - 5931
  • Route2
    • null|null
      108-24-7
    • null|null
      106-51-4
    • ~99%
    • In-stock
      1,2,4-Triacetoxybenzene|CS-0199182
      613-03-6

    References

    • Zaitsev, V.G.; Polozov, G.I.; Lakhvich, F.A. Chemistry of Natural Compounds, 1994 , vol. 30, # 2 p. 180 - 185 Khimiya Prirodnykh Soedinenii, 1994 , # 2 p. 197 - 203
  • Route3
    • 1,2,4-Tribenzyloxybenzene|CS-0771562
      7298-33-1
    • ~%
    • In-stock
      1,2,4-Triacetoxybenzene|CS-0199182
      613-03-6

    References

    • Journal of the Chemical Society [Section] C: Organic, , vol. <C>, p. 2253 - 2255

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   78.9
  • LogP   1.4625
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   3

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