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CS-W001157 4
Total: USD 88.00

4-Chloropyridine-2,6-dicarbonitrile

  • CAS No. 55306-66-6

  • Cat. No. CS-0120816
  • Purity≥97%
  • MDL No.None

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

4-Chloropyridine-2,6-dicarbonitrile|CS-0120816

Structure of 55306-66-6

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General Information

  • CAS No. 55306-66-6
  • Cat. No. CS-0120816
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₂ClN₃
  • Molecular Weight 163.56
  • Synonym(s) 4-Chloro-2,6-pyridinedicarbonitrile
  • SMILES N#CC1=NC(C#N)=CC(Cl)=C1

Description

4-Chloropyridine-2,6-dicarbonitrile features a rigid pyridine core bearing two electron-deficient nitrile groups and a chlorine substituent at the 4-position. This configuration enables selective coupling in cross-coupling reactions and facilitates integration into functionalized heterocycles for pharmaceutical and materials applications.

Application

4-Chloropyridine-2,6-dicarbonitrile serves as a versatile building block in medicinal chemistry and materials science, enabling efficient construction of nitrogen-containing heterocycles via nucleophilic substitution and cyclization reactions. Its dual nitrile groups enhance reactivity in transition-metal-catalyzed couplings, while the chlorine moiety facilitates downstream functionalization under mild conditions. The compound exhibits excellent bench stability and compatibility with standard purification techniques, making it well-suited for iterative synthesis campaigns and API intermediate development.

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302+H312-H315-H319-H331-H335
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.47
  • LogP   1.47836
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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