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4,4,4-Trifluorobutanal(CAS: 406-87-1)

4,4,4-Trifluorobutanal
CAS Number

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Basic Information

Molecular Formula
C4H5F3O
Molecular Weight
126.08 g/mol

Physical Properties

Boiling Point
96 ºC
Flash Point
-3.6±18.8 ºC,

Chemical Identifiers

SMILES
C(CC(F)(F)F)C=O
InChIKey
SCJCDNUXDWFVFI-UHFFFAOYSA-N

Database References

MDL Number
MFCD00190643

FAQ

4,4,4-Trifluorobutanal (CAS: 406-87-1) is a colorless liquid with a strong, pungent odor. It has a molecular weight of 130.06 g/mol and a boiling point of 95-97°C. The compound is slightly soluble in water but highly soluble in organic solvents. It is moderately reactive, particularly with nucleophiles, and can undergo keto-enol tautomerism.
4,4,4-Trifluorobutanal can be synthesized through the oxidative cleavage of 1,1,1-trifluoro-3-butanone using osmium tetroxide and acetone as catalysts. This method provides good yield and selectivity for the aldehyde product. Other routes include the reduction of trifluoroacetaldehyde with hydrogen over a metal catalyst.
4,4,4-Trifluorobutanal (CAS: 406-87-1) is used in the pharmaceutical industry for the synthesis of certain drugs due to its unique functional groups. It is also utilized in the polymer industry as a monomer for specialized polymers. Additionally, it has applications in sensors and semiconductors for its chemical reactivity and functional properties.
When handling 4,4,4-Trifluorobutanal (CAS: 406-87-1), ensure the use of appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work in a well-ventilated area or fume hood. Store the compound in a cool, dry place away from heat sources and direct sunlight. In case of spill, refer to the safety data sheet (SDS) for proper handling instructions and clean up using appropriate absorbents.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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