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CS-W001157 4
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4-Chloro-6-methylnicotinonitrile

  • CAS No. 38875-76-2

  • Cat. No. CS-D0529
  • Purity≥98%
  • MDL No.MFCD01078061

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

4-Chloro-6-methylnicotinonitrile|CS-D0529

Structure of 38875-76-2

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General Information

  • CAS No. 38875-76-2
  • Cat. No. CS-D0529
  • Purity ≥98%
  • MDL No. MFCD01078061
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅ClN₂
  • Molecular Weight 152.58
  • Synonym(s) 4-chloro-6-Methylpyridine-3-carbonitrile
  • SMILES N#CC1=CN=C(C)C=C1Cl

Description

4-Chloro-6-methylnicotinonitrile features a pyridine core functionalized with chlorine, methyl, and nitrile groups, enabling selective coupling in heterocyclic synthesis. This electron-deficient scaffold integrates readily into pharmaceutical intermediates and agrochemical frameworks, offering robust stability under standard reaction conditions.

Application

4-Chloro-6-methylnicotinonitrile serves as a versatile building block in medicinal chemistry, enabling efficient access to substituted pyridine scaffolds via cross-coupling and nucleophilic substitution reactions. The nitrile group facilitates downstream transformations to carboxylic acids or amides, while the chloro and methyl substituents provide orthogonal reactivity for sequential functionalization. Bench-stable and readily purified by recrystallization, it functions reliably in standard synthetic workflows.

Synthesis

  • Route1
    • null|null
      1073160-08-3
    • ~37%
    • In-stock
      4-Chloro-6-methylnicotinonitrile|CS-D0529
      38875-76-2

    References

    • Pfizer Inc. Patent: US2009/54395 A1, 2009 ; Location in patent: Page/Page column 44 ;

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   36.68
  • LogP   1.9151
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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