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CS-W001157 4
Total: USD 88.00

2,4,6-Trichloro-5-methylpyrimidine

  • CAS No. 1780-36-5

  • Cat. No. CS-W002538
  • Purity≥98%
  • MDL No.MFCD00233525

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

2,4,6-Trichloro-5-methylpyrimidine|CS-W002538

Structure of 1780-36-5

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General Information

  • CAS No. 1780-36-5
  • Cat. No. CS-W002538
  • Purity ≥98%
  • MDL No. MFCD00233525
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₃Cl₃N₂
  • Molecular Weight 197.45
  • Synonym(s) Pyrimidine, 2,4,6-trichloro-5-methyl-
  • SMILES Clc1nc(Cl)c(c(n1)Cl)C

Description

2,4,6-Trichloro-5-methylpyrimidine features a highly reactive pyrimidine core flanked by three chlorine atoms and a methyl group, enabling selective substitution under mild conditions. This electron-deficient heterocycle integrates efficiently into pharmaceutical intermediates and agrochemical scaffolds, offering enhanced stability during functionalization workflows.

Application

2,4,6-Trichloro-5-methylpyrimidine serves as a versatile building block in medicinal chemistry, enabling efficient introduction of multiple electrophilic sites for nucleophilic substitution reactions. Its electron-deficient pyrimidine core facilitates regioselective functionalization, while the methyl group enhances stability and modulates reactivity. The compound exhibits excellent bench stability and is readily purified by recrystallization, making it well-suited for use in multi-step synthesis of heterocyclic scaffolds and API intermediates.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P405-P501

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Computational Chemistry Data

  • TPSA   25.78
  • LogP   2.74522
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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