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Methyl 3,5-dibromo-2,4-dihydroxy-6-methylbenzoate

  • CAS No. 715-33-3

  • Cat. No. CS-0116696
  • Molecule weight339.97
  • Purity≥98%
  • MDL No.None

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

Methyl 3,5-dibromo-2,4-dihydroxy-6-methylbenzoate|CS-0116696

Structure of 715-33-3

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General Information

  • CAS No. 715-33-3
  • Cat. No. CS-0116696
  • Purity ≥98%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈Br₂O₄
  • Molecular Weight 339.97
  • Synonym(s) 3,5-dibromo-2,4-dihydroxy-6-methyl-benzoic acid methyl ester
  • SMILES O=C(OC)C1=C(C)C(Br)=C(O)C(Br)=C1O

Synthesis

  • Route1

    References

    • Justus Liebigs Annalen der Chemie, , vol. 125, p. 359 Justus Liebigs Annalen der Chemie, , vol. 149, p. 293
  • Route2
    • Methyl 2-methyl-4,6-dioxocyclohexanecarboxylate|CS-0117000
      56157-27-8
    • ~%
    • Methyl 3,5-dibromo-2,4-dihydroxy-6-methylbenzoate|CS-0116696
      715-33-3

    References

    • Journal of the Chemical Society, , p. 2908 - 2914

Safety Information

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

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   2.71782
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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