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CS-W001157 4
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Methyl 3,5-dibromo-4-methylbenzoate

  • CAS No. 74896-66-5

  • Cat. No. CS-0179383
  • Purity≥95%
  • MDL No.MFCD00010729

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

Methyl 3,5-dibromo-4-methylbenzoate|CS-0179383

Structure of 74896-66-5

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General Information

  • CAS No. 74896-66-5
  • Cat. No. CS-0179383
  • Purity ≥95%
  • MDL No. MFCD00010729
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈Br₂O₂
  • Molecular Weight 307.97
  • Synonym(s) Methyl 3,5-Dibromo-p-toluate
  • SMILES O=C(OC)C1=CC(Br)=C(C)C(Br)=C1

Description

α-D-Mannose pentaacetate is used for glycosylation in a study that assessed novel synthetic inhibitors of selectin-mediated cell adhesion. It has also been used in a study to investigate stereospecific entry to spiroketal glycosides using alkylidenecarbene C-H insertion.

Application

Methyl 3,5-dibromo-4-methylbenzoate serves as a versatile building block for brominated aromatic scaffolds in medicinal chemistry and materials science. The methyl ester group enables downstream transformations such as hydrolysis or coupling reactions, while the ortho-bromine substituents facilitate palladium-catalyzed cross-coupling processes. Bench-stable and readily purified by column chromatography, it functions efficiently in standard synthetic workflows requiring halogenated benzene intermediates.

Synthesis

  • Route1

    References

    • Manchand, Percy S.; Townsend, John M.; Belica, Peter S.; Wong, Harry S. Synthesis, 1980 , # 5 p. 409 - 410

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-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.30662
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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