1100052-58-1 | tert-Butyl 4-(4-bromophenyl)pyrazole-1-carboxylate

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$153.00	$107.00
5g	97%	in stock	$572.00	$400.00
25g	97%	in stock	$1,535.00	$1,074.00

Description

• Catalog Number: AI08057
• Chemical Name: tert-Butyl 4-(4-bromophenyl)pyrazole-1-carboxylate
• CAS Number: 1100052-58-1
• Molecular Formula: C14H15BrN2O2
• Molecular Weight: 323.1851
• MDL Number: MFCD28122678
• SMILES: Brc1ccc(cc1)c1cnn(c1)C(=O)OC(C)(C)C

Computed Properties

• Complexity: 322
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 19
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• XLogP3: 3.8

Upstream Synthesis Route

The tert-Butyl 4-(4-bromophenyl)pyrazole-1-carboxylate is a versatile compound commonly used in chemical synthesis due to its unique reactivity and structural properties. This compound plays a crucial role in various organic reactions, particularly in the synthesis of complex molecules and pharmaceutical intermediates.One key application of tert-Butyl 4-(4-bromophenyl)pyrazole-1-carboxylate is as a building block in the synthesis of heterocyclic compounds. Its pyrazole and ester functionalities enable the formation of diverse chemical bonds, allowing for the creation of novel structures with specific properties. Additionally, the presence of the tert-butyl and bromophenyl groups enhances the compound's stability and reactivity, making it a valuable component in the construction of intricate molecular frameworks.Furthermore, tert-Butyl 4-(4-bromophenyl)pyrazole-1-carboxylate serves as a key intermediate in the preparation of bioactive compounds and pharmaceuticals. Its versatile nature allows for the modification of its chemical structure to introduce desired pharmacological properties, making it a valuable tool in drug discovery and development.Overall, tert-Butyl 4-(4-bromophenyl)pyrazole-1-carboxylate is a vital reagent in chemical synthesis, enabling the construction of diverse molecules with potential applications in various fields, including pharmaceuticals, materials science, and agrochemicals.