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CAS 578-29-0

:

1-(2,5-Dimethyl-3-furanyl)-4,4,4-trifluoro-1,3-butanedione

Description:
1-(2,5-Dimethyl-3-furanyl)-4,4,4-trifluoro-1,3-butanedione, with the CAS number 578-29-0, is an organic compound characterized by its unique structure that includes a furan ring and a trifluoromethyl group. This compound typically exhibits a yellow to orange color and is known for its strong odor, which can be reminiscent of certain fruit flavors. It is a diketone, meaning it contains two carbonyl (C=O) functional groups, which contribute to its reactivity and potential applications in organic synthesis. The presence of trifluoromethyl groups enhances its lipophilicity and can influence its biological activity. This compound is often utilized in the synthesis of various pharmaceuticals and agrochemicals due to its ability to act as a versatile building block. Additionally, it may exhibit interesting properties such as fluorescence or specific interactions with biological targets, making it a subject of interest in medicinal chemistry and material science. Safety precautions should be taken when handling this compound, as it may pose health risks if inhaled or ingested.
Formula:C10H9F3O3
InChI:InChI=1S/C10H9F3O3/c1-5-3-7(6(2)16-5)8(14)4-9(15)10(11,12)13/h3H,4H2,1-2H3
InChI key:InChIKey=BHOMEGVDWHEJTQ-UHFFFAOYSA-N
SMILES:C(CC(C(F)(F)F)=O)(=O)C=1C=C(C)OC1C
Synonyms:
  • 1,3-Butanedione, 1-(2,5-dimethyl-3-furyl)-4,4,4-trifluoro-
  • 1,3-Butanedione, 1-(2,5-dimethyl-3-furanyl)-4,4,4-trifluoro-
  • 1-(2,5-Dimethyl-3-furanyl)-4,4,4-trifluoro-1,3-butanedione
  • NSC 80405
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