4068-76-2 | Methyl 5-bromosalicylate

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$9.00	$6.00
5g	97%	in stock	$10.00	$7.00
10g	97%	in stock	$17.00	$12.00

Description

• Catalog Number: AB75966
• Chemical Name: Methyl 5-bromosalicylate
• CAS Number: 4068-76-2
• Molecular Formula: C8H7BrO3
• Molecular Weight: 231.0434
• MDL Number: MFCD00016460
• SMILES: COC(=O)c1cc(Br)ccc1O
• NSC Number: 30264

Computed Properties

• Complexity: 172
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 3.6

Upstream Synthesis Route

Methyl 5-bromo-2-hydroxybenzoate is a key compound utilized in chemical synthesis for its versatile applications in various organic reactions. This compound is commonly used as a building block in the creation of pharmaceutical intermediates and fine chemicals. Its unique structure provides opportunities for selective functionalization and allows for the synthesis of diverse molecular structures.In chemical synthesis, Methyl 5-bromo-2-hydroxybenzoate can serve as a valuable starting material for the preparation of complex molecules through processes such as esterification, alkylation, and Suzuki-Miyaura coupling reactions. By incorporating this compound into a synthetic route, chemists can access a wide range of functionalized derivatives with tailored properties.Furthermore, the presence of the bromine and hydroxy groups in Methyl 5-bromo-2-hydroxybenzoate enables it to participate in a variety of transformations, including substitution, oxidation, and reduction reactions. This versatility makes it a valuable tool for researchers and synthetic chemists working in fields such as medicinal chemistry, agrochemicals, and material science.Overall, Methyl 5-bromo-2-hydroxybenzoate plays a crucial role in modern chemical synthesis by offering a strategic entry point for the construction of complex organic molecules with biological and industrial relevance.