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CAS 29113-64-2

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3-Furancarboxylic acid, 2-methyl-5-phenyl-, ethyl ester

Description:
3-Furancarboxylic acid, 2-methyl-5-phenyl-, ethyl ester, identified by CAS number 29113-64-2, is an organic compound characterized by its ester functional group derived from a furan ring. This compound features a furan moiety substituted with a carboxylic acid group and an ethyl ester, along with a methyl and a phenyl group, contributing to its structural complexity. It is typically a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. The presence of the furan ring imparts unique chemical properties, including potential reactivity in various organic reactions, such as esterification and nucleophilic substitutions. This compound may exhibit moderate solubility in organic solvents and limited solubility in water, which is common for many esters. Its derivatives and related compounds are of interest in fields such as pharmaceuticals, agrochemicals, and materials science due to their potential biological activities and applications in synthesis. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C14H14O3
InChI:InChI=1S/C14H14O3/c1-3-16-14(15)12-9-13(17-10(12)2)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3
InChI key:InChIKey=GFYBATGIZAOPJC-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=C(OC1C)C2=CC=CC=C2
Synonyms:
  • 5-Phenyl-2-methyl-3-furoic acid ethyl ester
  • Ethyl 2-methyl-5-phenyl-3-furancarboxylate
  • 3-Furancarboxylic acid, 2-methyl-5-phenyl-, ethyl ester
  • 3-Furoic acid, 2-methyl-5-phenyl-, ethyl ester
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