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CAS 23085-60-1

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Phenylmethyl 2,4-dibromobutanoate

Description:
Phenylmethyl 2,4-dibromobutanoate, with the CAS number 23085-60-1, is an organic compound characterized by its ester functional group. It features a phenylmethyl group attached to a butanoate moiety that is further substituted with two bromine atoms at the 2 and 4 positions of the butanoate chain. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is known for its moderate to low solubility in water, but it is more soluble in organic solvents such as ethanol and acetone. The presence of bromine atoms contributes to its reactivity, making it useful in various chemical synthesis processes, including as an intermediate in the production of pharmaceuticals and agrochemicals. Additionally, the phenylmethyl group can impart unique electronic and steric properties, influencing the compound's behavior in chemical reactions. Safety precautions should be taken when handling this substance, as it may pose health risks if inhaled or ingested.
Formula:C11H12Br2O2
InChI:InChI=1S/C11H12Br2O2/c12-7-6-10(13)11(14)15-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI key:InChIKey=XQJJSEGHTSUQBZ-UHFFFAOYSA-N
SMILES:C(OC(C(CCBr)Br)=O)C1=CC=CC=C1
Synonyms:
  • Benzyl 2,4-dibromobutyrate
  • Phenylmethyl 2,4-dibromobutanoate
  • Butyric acid, 2,4-dibromo-, benzyl ester
  • Benzyl 2,4-dibromobutanoate
  • Butanoic acid, 2,4-dibromo-, phenylmethyl ester
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