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CS-W001157 4
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Methyl 2-(6-chloropyrimidin-4-yl)acetate

  • CAS No. 1097779-00-4

  • Cat. No. CS-0076300
  • Molecule weight186.60
  • Purity≥96%
  • MDL No.MFCD11520447

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

Methyl 2-(6-chloropyrimidin-4-yl)acetate|CS-0076300

Structure of 1097779-00-4

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General Information

  • CAS No. 1097779-00-4
  • Cat. No. CS-0076300
  • Purity ≥96%
  • MDL No. MFCD11520447
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇ClN₂O₂
  • Molecular Weight 186.60
  • Synonym(s) Methyl 2-​(6-​chloropyrimidin-​4-​yl)​acetate
  • SMILES O=C(OC)CC1=CC(Cl)=NC=N1

Description

Methyl 2-(6-chloropyrimidin-4-yl)acetate features a chloropyrimidine core linked to a methyl acetate group, enabling direct incorporation into heterocyclic scaffolds. This bench-stable, moisture-tolerant reagent facilitates efficient coupling reactions in medicinal chemistry workflows. The electron-deficient pyrimidine ring enhances reactivity toward nucleophiles, streamlining access to bioactive derivatives.

Application

Methyl 2-(6-chloropyrimidin-4-yl)acetate serves as a versatile building block in medicinal chemistry, enabling efficient construction of pyrimidine-based scaffolds. The chloropyrimidine moiety facilitates nucleophilic substitution reactions, while the ester group offers compatibility with standard functional group manipulations. Its bench-stable nature and straightforward purification make it well-suited for use in multi-step syntheses targeting kinase inhibitors and antiviral agents.

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   0.8455
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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