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CS-W001157 4
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Methyl 5-bromo-3-(trifluoromethyl)picolinate

  • CAS No. 1214328-84-3

  • Cat. No. CS-W005680
  • Purity≥97%
  • MDL No.MFCD14698001

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

Methyl 5-bromo-3-(trifluoromethyl)picolinate|CS-W005680

Structure of 1214328-84-3

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General Information

  • CAS No. 1214328-84-3
  • Cat. No. CS-W005680
  • Purity ≥97%
  • MDL No. MFCD14698001
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrF₃NO₂
  • Molecular Weight 284.03
  • Synonym(s) Methyl 5-bromo-3-(trifluoromethyl)-2-pyridinecarboxylate
  • SMILES BrC1=CN=C(C(=C1)C(F)(F)F)C(=O)OC

Description

Methyl 5-bromo-3-(trifluoromethyl)picolinate features a trifluoromethyl group at the 3-position and a bromo substituent at the 5-position of the picolinate ring, enabling selective cross-coupling reactions. The ester functionality supports derivatization, while the electron-withdrawing trifluoromethyl moiety enhances reactivity in transition-metal-catalyzed transformations. This compound serves as a key building block for bioactive heterocycles and pharmaceutical intermediates under standard conditions.

Application

Methyl 5-bromo-3-(trifluoromethyl)picolinate serves as a versatile building block in medicinal chemistry and heterocyclic synthesis. The bromo group enables palladium-catalyzed cross-coupling reactions, while the trifluoromethyl and ester functionalities offer enhanced metabolic stability and tunable polarity. This compound exhibits excellent bench stability and facilitates efficient functionalization in late-stage diversification strategies.

Safety Information

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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

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   2.6495
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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