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CAS 127437-29-0

:

diethyl 5-bromobenzene-1,3-dicarboxylate

Description:
Diethyl 5-bromobenzene-1,3-dicarboxylate is an organic compound characterized by its structure, which includes a bromine atom attached to a benzene ring that is further substituted with two ester functional groups derived from diethyl malonate. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in organic solvents such as ethanol and dichloromethane but has limited solubility in water due to its hydrophobic aromatic structure. The presence of the bromine atom enhances its reactivity, making it a useful intermediate in various organic synthesis reactions, including nucleophilic substitutions and coupling reactions. Additionally, the diethyl ester groups contribute to its ability to participate in condensation reactions, making it valuable in the synthesis of more complex molecules. Safety precautions should be taken when handling this compound, as it may pose health risks if inhaled or ingested, and appropriate personal protective equipment should be used.
Formula:C12H13BrO4
InChI:InChI=1/C12H13BrO4/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7H,3-4H2,1-2H3
SMILES:CCOC(=O)c1cc(cc(c1)Br)C(=O)OCC
Synonyms:
  • diethyl 5-bromobenzene-1,3-dicarboxylate
  • 1,3-Benzenedicarboxylic acid, 5-bromo-, 1,3-diethyl ester
  • DIETHYL 5-BROMOISOPHTHALATE
  • See more synonyms
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