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CS-W001157 4
Total: USD 88.00

4,6-Dimethoxypyrimidine-5-carboxylic acid

  • CAS No. 4319-93-1

  • Cat. No. CS-0051093
  • Purity≥98%
  • MDL No.None

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

4,6-Dimethoxypyrimidine-5-carboxylic acid|CS-0051093

Structure of 4319-93-1

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General Information

  • CAS No. 4319-93-1
  • Cat. No. CS-0051093
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₂O₄
  • Molecular Weight 184.15
  • Synonym(s) 5-Pyrimidinecarboxylic acid, 4,6-dimethoxy- (7CI,8CI,9CI)
  • SMILES COC1=NC=NC(OC)=C1C(O)=O

Description

4,6-Dimethoxypyrimidine-5-carboxylic acid features a pyrimidine core functionalized with two methoxy groups and a carboxylic acid at the 5-position, offering enhanced solubility and stability under standard conditions. This scaffold serves as a key building block in medicinal chemistry, enabling efficient incorporation into bioactive molecules through coupling reactions.

Application

4,6-Dimethoxypyrimidine-5-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of pyrimidine-based scaffolds through established coupling and cyclization protocols. Its ortho-dicarbonyl motif facilitates efficient functionalization and offers enhanced bench stability compared to analogous intermediates. The molecule functions effectively in amide bond formation and transition-metal-catalyzed cross-coupling reactions, supporting scalable access to heterocyclic compounds with defined regiochemistry.

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   81.54
  • LogP   0.192
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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