CAS 113641-88-6
:Ethyl 3-bromo-4-(bromomethyl)benzoate
Description:
Ethyl 3-bromo-4-(bromomethyl)benzoate is an organic compound characterized by its ester functional group, which is derived from benzoic acid. This compound features a benzene ring substituted with bromine atoms at the 3 and 4 positions, as well as an ethyl ester group. The presence of bromine substituents enhances its reactivity, making it useful in various chemical reactions, including nucleophilic substitutions and coupling reactions. Ethyl 3-bromo-4-(bromomethyl)benzoate is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in organic solvents like ethanol and dichloromethane but has limited solubility in water due to its hydrophobic aromatic structure. This compound is of interest in synthetic organic chemistry, particularly in the development of pharmaceuticals and agrochemicals, due to its potential as an intermediate in the synthesis of more complex molecules. Safety precautions should be taken when handling this compound, as it may pose health risks associated with brominated compounds.
Formula:C10H10Br2O2
InChI:InChI=1S/C10H10Br2O2/c1-2-14-10(13)7-3-4-8(6-11)9(12)5-7/h3-5H,2,6H2,1H3
InChI key:InChIKey=MCAHIXAOUIEVOC-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=CC(Br)=C(CBr)C=C1
Synonyms:- Benzoic acid, 3-bromo-4-(bromomethyl)-, ethyl ester
- Ethyl 3-bromo-4-(bromomethyl)benzoate
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