674287-63-9 | 5-Bromo-1H-1,2,4-triazole-3-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$9.00	$7.00
250mg	98%	in stock	$18.00	$13.00
1g	98%	in stock	$52.00	$37.00
5g	98%	in stock	$220.00	$154.00
10g	98%	in stock	$420.00	$294.00

Description

• Catalog Number: AB50781
• Chemical Name: 5-Bromo-1H-1,2,4-triazole-3-carboxylic acid
• CAS Number: 674287-63-9
• Molecular Formula: C3H2BrN3O2
• Molecular Weight: 191.9709
• MDL Number: MFCD11040182
• SMILES: OC(=O)c1nnc([nH]1)Br

Computed Properties

• Complexity: 130
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 9
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 0.9

Upstream Synthesis Route

5-Bromo-1H-1,2,4-triazole-3-carboxylic acid is a versatile building block widely utilized in chemical synthesis for various applications. This compound serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and materials with unique properties. Its structural characteristics make it a valuable tool in the production of complex molecules with diverse functionalities. In particular, 5-Bromo-1H-1,2,4-triazole-3-carboxylic acid is commonly employed in the development of bioactive compounds, including kinase inhibitors and fluorescent dyes. Furthermore, its compatibility with a range of reaction conditions makes it a favored choice for creating novel molecular structures with tailored properties for multiple industries.