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CS-W001157 4
Total: USD 88.00

2-(tert-Butyl)-4,6-dichloropyrimidine

  • CAS No. 1044771-51-8

  • Cat. No. CS-0432815
  • Purity≥97%
  • MDL No.None

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

2-(tert-Butyl)-4,6-dichloropyrimidine|CS-0432815

Structure of 1044771-51-8

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General Information

  • CAS No. 1044771-51-8
  • Cat. No. CS-0432815
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀Cl₂N₂
  • Molecular Weight 205.08
  • Synonym(s) 2-tert-butyl-4,6-dichloropyrimidine
  • SMILES CC(C1=NC(Cl)=CC(Cl)=N1)(C)C

Description

2-(tert-Butyl)-4,6-dichloropyrimidine features a sterically shielded tert-butyl group that enhances stability and solubility in organic media. The dichloro substitution at the 4- and 6-positions provides high electrophilicity for nucleophilic displacement reactions. This pyrimidine scaffold integrates readily into functionalized heterocycles under standard coupling conditions.

Application

2-(tert-Butyl)-4,6-dichloropyrimidine serves as a versatile building block in medicinal chemistry and agrochemical synthesis. Its dichloropyrimidine core enables efficient nucleophilic substitution reactions, facilitating the installation of diverse aryl, heteroaryl, and amino substituents under mild conditions. The tert-butyl group enhances steric stability and solubility, improving handling and purification. This compound functions reliably in standard coupling protocols, supporting scalable synthesis of complex heterocyclic scaffolds.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   25.78
  • LogP   3.0809
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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