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CS-W001157 4
Total: USD 88.00

Ethyl 2,4,6-trihydroxybenzoate

  • CAS No. 90536-74-6

  • Cat. No. CS-0024361
  • Purity≥98%
  • MDL No.MFCD06204294

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

Ethyl 2,4,6-trihydroxybenzoate|CS-0024361

Structure of 90536-74-6

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General Information

  • CAS No. 90536-74-6
  • Cat. No. CS-0024361
  • Purity ≥98%
  • MDL No. MFCD06204294
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₅
  • Molecular Weight 198.17
  • Synonym(s) Benzoic acid, 2,4,6-trihydroxy-, ethyl ester
  • SMILES O=C(C1=C(O)C=C(O)C=C1O)OCC

Synthesis

  • Route1

    References

    • Exegenics Inc. Patent: US6828350 B1, 2004 ; Location in patent: Page/Page column 17 ;
  • Route2
    • null|null
      75-03-6
    • ~%
    • Ethyl 2,4,6-trihydroxybenzoate|CS-0024361
      90536-74-6

    References

    • Herzig; Erthal Monatshefte fuer Chemie, 1911 , vol. 32, p. 498
  • Route3
    • null|null
      227946-76-1
    • ~%
    • Ethyl 2,4,6-trihydroxybenzoate|CS-0024361
      90536-74-6

    References

    • Sonn Chemische Berichte, 1919 , vol. 52, p. 259

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

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Computational Chemistry Data

  • TPSA   86.99
  • LogP   0.9801
  • H_Acceptors   5
  • H_Donors   3
  • Rotatable_Bonds   2

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