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CS-W001157 4
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Methyl 2,4-Dichloropyrimidine-5-carboxylate

  • CAS No. 3177-20-6

  • Cat. No. CS-W003694
  • Purity≥97%
  • MDL No.MFCD09910342

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

Methyl 2,4-Dichloropyrimidine-5-carboxylate|CS-W003694

Structure of 3177-20-6

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General Information

  • CAS No. 3177-20-6
  • Cat. No. CS-W003694
  • Purity ≥97%
  • MDL No. MFCD09910342
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄Cl₂N₂O₂
  • Molecular Weight 207.01
  • Synonym(s) None
  • SMILES COC(=O)c1cnc(nc1Cl)Cl

Description

Methyl 2,4-dichloropyrimidine-5-carboxylate features a pyrimidine core with strategically positioned chloro and ester groups, enabling direct functionalization in medicinal chemistry. The electron-deficient ring facilitates nucleophilic substitution, while the methyl ester serves as a handle for downstream derivatization. This compound delivers high reactivity under mild conditions, streamlining access to advanced heterocyclic scaffolds.

Application

Methyl 2,4-dichloropyrimidine-5-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling efficient access to substituted pyrimidines via nucleophilic displacement. The dichloro substitution pattern facilitates sequential functionalization at C2 and C4, while the ester group allows for further derivatization or hydrolysis. Its bench-stable nature and compatibility with diverse reaction conditions make it a practical choice for medicinal chemistry and process development workflows.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.08
  • LogP   1.57
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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