105020-39-1 | Methyl 2-methyl-1,2,3-triazole-4-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	in stock	$88.00	$62.00
250mg	95%	in stock	$149.00	$105.00
1g	95%	in stock	$365.00	$256.00
5g	95%	in stock	$1,490.00	$1,043.00

Description

• Catalog Number: AB75644
• Chemical Name: Methyl 2-methyl-1,2,3-triazole-4-carboxylate
• CAS Number: 105020-39-1
• Molecular Formula: C5H7N3O2
• Molecular Weight: 141.128
• MDL Number: MFCD16495898
• SMILES: COC(=O)c1cnn(n1)C

Computed Properties

• Complexity: 139
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• XLogP3: 0.4

Upstream Synthesis Route

With its unique structure and versatile reactivity, Methyl 2-Methyl-1,2,3-triazole-4-carboxylate serves as a valuable building block in chemical synthesis. This compound is commonly utilized in the formation of various heterocyclic compounds through the incorporation of the triazole moiety. By selectively modulating the substituents and functional groups attached to the triazole ring, chemists can fine-tune the properties and biological activities of the synthesized molecules. Furthermore, the presence of the ester group in Methyl 2-Methyl-1,2,3-triazole-4-carboxylate enables facile modification and derivatization, making it a key intermediate in the production of pharmaceuticals, agrochemicals, and materials with tailored properties. Its application extends to the development of new drugs, advanced materials, and bioactive molecules through strategic synthetic pathways that exploit the reactivity and stability of this key intermediate.

Literature

• Methyl 2-methyl-2H-1,2,3-triazole-4-carboxyl-ate.

  Acta crystallographica. Section E, Structure reports online 20090801