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CAS 382-01-4

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3-bromo-1,1,1-trifluoro-2-butanone

Description:
3-Bromo-1,1,1-trifluoro-2-butanone is a halogenated ketone characterized by the presence of a bromine atom and three fluorine atoms attached to a butanone structure. Its molecular formula is C4H4BrF3O, indicating a relatively low molecular weight. The compound is typically a colorless to pale yellow liquid with a distinctive odor. It is known for its reactivity due to the presence of both the bromine and trifluoromethyl groups, which can participate in various chemical reactions, including nucleophilic substitutions and additions. The trifluoromethyl group enhances the compound's lipophilicity and stability, making it useful in organic synthesis and as an intermediate in the production of pharmaceuticals and agrochemicals. Additionally, 3-bromo-1,1,1-trifluoro-2-butanone is subject to regulations due to its potential environmental and health impacts, particularly concerning its halogenated nature. Proper handling and disposal are essential to mitigate any risks associated with its use.
Formula:C4H4BrF3O
InChI:InChI=1S/C4H4BrF3O/c1-2(5)3(9)4(6,7)8/h2H,1H3
InChI key:InChIKey=MHSGADWWPRDQNH-UHFFFAOYSA-N
SMILES:C(C(F)(F)F)(C(Br)C)=O
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