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CS-W001157 4
Total: USD 88.00

2,3,5,6-Tetramethylbenzoic acid

  • CAS No. 2604-45-7

  • Cat. No. CS-0204342
  • Purity≥95%
  • MDL No.MFCD00013981

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

2,3,5,6-Tetramethylbenzoic acid|CS-0204342

Structure of 2604-45-7

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General Information

  • CAS No. 2604-45-7
  • Cat. No. CS-0204342
  • Purity ≥95%
  • MDL No. MFCD00013981
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₂
  • Molecular Weight 178.23
  • Synonym(s) 2,3,5,6-tetramethyl-benzoicaci
  • SMILES O=C(O)C=1C(=C(C=C(C1C)C)C)C

Synthesis

  • Route1

    References

    • Fuson; Kelton Journal of the American Chemical Society, 1941 , vol. 63, p. 1500 Full Text View citing articles Show Details Coops et al. Recueil des Travaux Chimiques des Pays-Bas, 1940 , vol. 59, p. 1109,1111 Full Text Show Details Weizmann Journal of the American Chemical Society, 1948 , vol. 70, p. 2342
  • Route2
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      95-93-2
    • ~%
    • 2,3,5,6-Tetramethylbenzoic acid|CS-0204342
      2604-45-7

    References

    • Jacobsen Chemische Berichte, 1889 , vol. 22, p. 1217
  • Route3
    • null|null
      463-72-9
    • null|null
      95-93-2
    • ~%
    • 2,3,5,6-Tetramethylbenzoic acid|CS-0204342
      2604-45-7

    References

    • Gattermann Chemische Berichte, 1899 , vol. 32, p. 1119 Justus Liebigs Annalen der Chemie, 1888 , vol. 244, p. 55

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-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   37.3
  • LogP   2.61848
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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