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CS-W001157 4
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Methyl 6-chloro-5-methylpicolinate

  • CAS No. 178421-22-2

  • Cat. No. CS-W022878
  • Purity≥98%
  • MDL No.None

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

Methyl 6-chloro-5-methylpicolinate|CS-W022878

Structure of 178421-22-2

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General Information

  • CAS No. 178421-22-2
  • Cat. No. CS-W022878
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈ClNO₂
  • Molecular Weight 185.61
  • Synonym(s) 6-CHLORO-5-METHYL-PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER
  • SMILES O=C(OC)C1=NC(Cl)=C(C)C=C1

Description

Methyl 6-chloro-5-methylpicolinate is a bench-stable, electron-deficient heterocyclic ester featuring a chlorinated pyridine core with orthogonal methyl and ester functionalities. This structural motif enables direct incorporation into cross-coupling cascades and serves as a key scaffold for medicinal chemistry libraries.

Application

Methyl 6-chloro-5-methylpicolinate serves as a versatile building block in medicinal chemistry and heterocyclic synthesis, enabling direct functionalization at the pyridine ring due to orthogonal reactivity of the chloro and methyl groups. Its bench-stable nature and compatibility with palladium-catalyzed cross-coupling reactions facilitate efficient construction of complex scaffolds. The ester functionality supports subsequent transformations including hydrolysis and amidation, making it valuable for API intermediate development.

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   1.83002
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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