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CS-W001157 4
Total: USD 88.00

Methyl 3-bromobenzoate

  • CAS No. 618-89-3

  • Cat. No. CS-W005465
  • Purity≥97%
  • MDL No.MFCD00017777

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

Methyl 3-bromobenzoate|CS-W005465

Structure of 618-89-3

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General Information

  • CAS No. 618-89-3
  • Cat. No. CS-W005465
  • Purity ≥97%
  • MDL No. MFCD00017777
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO₂
  • Molecular Weight 215.04
  • Synonym(s) Methyl-3-brombenzolcarboxylat
  • SMILES O=C(OC)C1=CC=CC(Br)=C1

Description

Methyl 3-bromobenzoate features a bromine substituent at the meta position relative to the ester group, enabling selective functionalization in cross-coupling reactions. This bench-stable, moisture-tolerant reagent integrates readily into synthetic sequences requiring halogen-directed derivatization.

Synthesis

  • Route1
    • null|null
      93-58-3
    • ~98%
    • In-stock
      Methyl 3-bromobenzoate|CS-W005465
      618-89-3

    References

    • Chemistry Letters, , vol. 32, # 10 p. 932 - 933
  • Route2
    • null|null
      67-56-1
    • In-stock
      3-Bromobenzoic acid|CS-W019787
      585-76-2
    • ~96%
    • In-stock
      Methyl 3-bromobenzoate|CS-W005465
      618-89-3

    References

    • Journal of the Chilean Chemical Society, , vol. 57, # 4 p. 1492 - 1496
  • Route3

    References

    • US5622937 A1, ;

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.2357
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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