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CS-W001157 4
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Methyl 5-fluoropyrimidine-2-carboxylate

  • CAS No. 1227575-47-4

  • Cat. No. CS-0038962
  • Purity≥95%
  • MDL No.MFCD16611615

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

Methyl 5-fluoropyrimidine-2-carboxylate|CS-0038962

Structure of 1227575-47-4

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General Information

  • CAS No. 1227575-47-4
  • Cat. No. CS-0038962
  • Purity ≥95%
  • MDL No. MFCD16611615
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅FN₂O₂
  • Molecular Weight None
  • Synonym(s) Methyl 5-fluoro-2-pyrimidinecarboxylate
  • SMILES COC(=O)C1=NC=C(C=N1)F

Description

Methyl 5-fluoropyrimidine-2-carboxylate features a fluorinated pyrimidine core with a methyl ester group, offering enhanced stability and solubility in organic media. This electrophilic scaffold integrates readily into heterocyclic syntheses, enabling efficient access to bioactive compounds through cross-coupling or nucleophilic substitution reactions under standard conditions.

Application

Methyl 5-fluoropyrimidine-2-carboxylate serves as a versatile building block in medicinal chemistry, enabling efficient access to fluorinated pyrimidine scaffolds. The ester group facilitates downstream functionalization, while the 5-fluoro substitution supports nucleophilic aromatic substitution and transition-metal-catalyzed coupling reactions. Its bench stability and compatibility with standard synthetic protocols make it ideal for constructing bioactive heterocycles and API intermediates.

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

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Computational Chemistry Data

  • TPSA   52.08
  • LogP   0.4023
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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