Chemical Identity
Molecular Formula
C5H4F6O2
Molecular Weight
210.07 g/mol
Exact Mass
210.011548
PubChem CID
2736186
SMILES String
CC(C(=O)O)(C(F)(F)F)C(F)(F)F
Names & Synonyms
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External Identifiers
Catalog Overview
3,3,3-Trifluoro-2-methyl-2-(trifluoromethyl)propanoic acid, with CAS number 45048-36-0 and molecular formula C5H4F6O2, is a highly fluorinated organic acid. It features two trifluoromethyl groups and a methyl group attached to the alpha-carbon of a propanoic acid backbone. This structural motif makes it a valuable reagent in synthetic chemistry, especially for the preparation of fluorinated pharmaceuticals, agrochemicals, and materials. Its strong electron-withdrawing trifluoromethyl groups can influence the acidity and reactivity of the carboxylic acid, making it a unique building block for various research applications requiring...
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
3,3,3-Trifluoro-2-methyl-2-(trifluoromethyl)propanoic acid, with CAS number 45048-36-0 and molecular formula C5H4F6O2, is a highly fluorinated organic acid. It features two trifluoromethyl groups and a methyl group attached to the alpha-carbon of a propanoic acid backbone. This structural motif makes it a valuable reagent in synthetic chemistry, especially for the preparation of fluorinated pharmaceuticals, agrochemicals, and materials. Its strong electron-withdrawing trifluoromethyl groups can influence the acidity and reactivity of the carboxylic acid, making it a unique building block for various research applications requiring fluorinated functionalities. It is intended for Research Use Only (RUO).
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
Colorless liquid
Physical State
Liquid
Melting Point
-3.0 °C
Boiling Point
170.0 °C
Density
1.55 g/cm³
Water Solubility
Soluble
Flash Point
28.9 °C
Applications / Classifications
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary safety-style information for reference only. Not a supplier SDS.
Handling and Storage
- Handle 3,3,3-Trifluoro-2-methyl-2-(trifluoromethyl)propanoic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including chemical-resistant gloves, safety glasses or goggles, and a lab coat. Avoid inhalation of dust or vapors, and prevent skin and eye contact. In case of contact, rinse immediately with plenty of water and seek medical advice. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for comprehensive safety information before use. This compound is for Research Use Only.
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