Description
Hexanoic acid, 2,2,2-trifluoroethyl ester (CAS No. 2822-57-3) is a high-purity fluorinated ester compound with the molecular formula C8H13F3O2. Also known as 2,2,2-trifluoroethyl hexanoate, this specialty chemical is characterized by its unique trifluoroethyl group, which enhances its reactivity and solubility in organic matrices. It is supplied as a clear, colorless to pale-yellow liquid with a characteristic ester-like odor, suitable for advanced synthetic applications. Ideal for researchers and scientists, this compound is rigorously tested for consistency, ensuring optimal performance in catalysis, material science, and pharmaceutical intermediates. Store in a cool, dry place under inert conditions to maintain stability.
Properties
- CAS Number: 2822-57-3
- Complexity: 154
- IUPAC Name: 2,2,2-trifluoroethyl hexanoate
- InChI: InChI=1S/C8H13F3O2/c1-2-3-4-5-7(12)13-6-8(9,10)11/h2-6H2,1H3
- InChI Key: ORAXWUYWHLAHCG-UHFFFAOYSA-N
- Exact Mass: 198.08676414
- Molecular Formula: C8H13F3O2
- Molecular Weight: 198.18
- SMILES: CCCCCC(=O)OCC(F)(F)F
- Topological: 26.3
- Monoisotopic Mass: 198.08676414
- Synonyms: Hexanoic acid, 2,2,2-trifluoroethyl ester, SCHEMBL2692664, 2,2,2-Trifluoroethyl?Hexanoate, 2822-57-3
Application
Hexanoic acid, 2,2,2-trifluoroethyl ester is widely utilized as a versatile building block in organic synthesis, particularly for introducing trifluoroethyl groups into target molecules. Its applications include serving as a precursor for fluorinated polymers and specialty materials with enhanced thermal and chemical resistance. Researchers also employ it in pharmaceutical development for modifying drug solubility and bioavailability. Additionally, it finds use in agrochemical formulations and as a solvent or co-solvent in high-performance coatings.
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