CAS 4664-45-3

5-(4-methylbenzyl)furan-2-carboxylic acid

Description:

5-(4-Methylbenzyl)furan-2-carboxylic acid, with the CAS number 4664-45-3, is an organic compound characterized by its furan ring structure, which is a five-membered aromatic ring containing oxygen. This compound features a carboxylic acid functional group (-COOH) at the 2-position of the furan, contributing to its acidity and reactivity. The presence of a 4-methylbenzyl group at the 5-position enhances its hydrophobic characteristics and can influence its solubility in various solvents. Typically, compounds like this exhibit moderate to high melting points and may be soluble in organic solvents while being less soluble in water due to their hydrophobic nature. The compound may also participate in various chemical reactions, including esterification and amidation, due to the reactive carboxylic acid group. Its unique structure may lend itself to applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. As with many organic compounds, safety data should be consulted for handling and usage.

Formula: C₁₃H₁₂O₃

InChI: InChI=1/C13H12O3/c1-9-2-4-10(5-3-9)8-11-6-7-12(16-11)13(14)15/h2-7H,8H2,1H3,(H,14,15)

SMILES: Cc1ccc(cc1)Cc1ccc(C(=O)O)o1

Synonyms:

• 2-Furancarboxylic Acid, 5-[(4-Methylphenyl)Methyl]-