Methyl pyrimidine-5-carboxylate

Name: Methyl pyrimidine-5-carboxylate
Brand: ChemScene
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CAS No. 34253-01-5
Cat. No. CS-D0147
Purity≥96%
MDL No.MFCD06204205

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Methyl pyrimidine-5-carboxylate|CS-D0147

Structure of 34253-01-5

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General Information

CAS No. 34253-01-5
Cat. No. CS-D0147
Purity ≥96%
MDL No. MFCD06204205
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₆N₂O₂
Molecular Weight 138.12
Synonym(s) 5-Pyrimidinecarboxylic acid, methylester
SMILES O=C(C1=CN=CN=C1)OC

Description

Methyl pyrimidine-5-carboxylate is a bench-stable heterocyclic ester featuring a pyrimidine core with a carboxylate group at the 5-position. This electron-deficient scaffold integrates readily into synthetic sequences, serving as a key building block for pharmaceutical intermediates and functional materials.

Application

Methyl pyrimidine-5-carboxylate serves as a versatile building block in medicinal chemistry and heterocyclic synthesis, enabling efficient access to pyrimidine-based scaffolds. Its ester functionality supports diverse transformations including hydrolysis, nucleophilic substitution, and transition-metal-catalyzed coupling reactions. The molecule exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthetic campaigns targeting bioactive compounds.

Synthesis

Route1
- In-stock
  
  4595-59-9
- 67-56-1
- 201230-82-2
- ~44%
- In-stock
  
  34253-01-5
References
- Young, Jonathan R.; Huang, Song X.; Chen, Irene; Walsh, Thomas F.; DeVita, Robert J.; Wyvratt Jr., Matthew J.; Goulet, Mark T.; Ren, Ning; Lo, Jane; Yang, Yi Tien; Yudkovitz, Joel B.; Cheng, Kang; Smith, Roy G. Bioorganic and Medicinal Chemistry Letters, 2000 , vol. 10, # 15 p. 1723 - 1727
Route2
- In-stock
  
  4595-61-3
- ~%
- In-stock
  
  34253-01-5
References
- US5175166 A1, ; US 5175166 A

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: 1759
Class : 8	Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 52.08
LogP 0.2632
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Key Words

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Methyl pyrimidine-5-carboxylate

CAS No. 34253-01-5

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