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CAS 4833-99-2

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Butanoic acid, 4-bromo-2,2-dimethyl-, methyl ester

Description:
Butanoic acid, 4-bromo-2,2-dimethyl-, methyl ester, with the CAS number 4833-99-2, is an organic compound characterized by its ester functional group derived from butanoic acid. This compound features a bromine atom at the 4-position and two methyl groups at the 2-position of the butanoic acid backbone, contributing to its unique structural properties. It is typically a colorless to pale yellow liquid with a distinctive odor, characteristic of esters. The presence of the bromine atom can influence its reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions. Its molecular structure suggests moderate polarity, which can affect its solubility in different solvents. Butanoic acid derivatives are often studied for their applications in organic synthesis, flavoring agents, and as intermediates in the production of pharmaceuticals. Safety data should be consulted for handling, as halogenated compounds can pose health risks. Overall, this compound exemplifies the diverse chemistry of esters and their functional applications in various fields.
Formula:C7H13BrO2
InChI:InChI=1S/C7H13BrO2/c1-7(2,4-5-8)6(9)10-3/h4-5H2,1-3H3
InChI key:InChIKey=LSEMRAPWMAYTFA-UHFFFAOYSA-N
SMILES:C(C(OC)=O)(CCBr)(C)C
Synonyms:
  • Butyric acid, 4-bromo-2,2-dimethyl-, methyl ester
  • Methyl 2,2-dimethyl-4-bromobutanoate
  • 4-Bromo-2,2-dimethylbutanoic acid methyl ester
  • Methyl 4-bromo-2,2-dimethylbutanoate
  • Butanoic acid, 4-bromo-2,2-dimethyl-, methyl ester
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