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Ethyl 4,4,4-trifluoro-3-hydroxy-2-methylene-3-(trifluoromethyl)butanoate

CAS 152251-75-7Formula C8H8F6O3MW 266.14PubChem 15040536

This compound is a highly fluorinated ethyl ester featuring a trifluoromethylated tertiary alcohol and an acrylate moiety. It serves as a versatile building block for research and development in organic synthesis, particularly for introducing fluorinated groups and reactive alkene functionalities into novel compounds.

Loading RDKit molecule structure...
InChIKey: PMHBUHIZSGSMQJ-UHFFFAOYSA-NC8H8F6O3 | MW 266.14

Chemical Identity

Molecular Formula

C8H8F6O3

Molecular Weight

266.14 g/mol

Exact Mass

266.037763

PubChem CID

15040536

IUPAC Name

ethyl 4,4,4-trifluoro-3-hydroxy-2-methylidene-3-(trifluoromethyl)butanoate

SMILES String

C=C(C(=O)OCC)C(O)(C(F)(F)F)C(F)(F)F

Names & Synonyms

821-119-1C8H8F6O3ethyl 2-(alpha-hydroxyhexafluoroisopropyl)acrylateEthyl4,4,4-trifluoro-3-hydroxy-2-methylene-3-(trifluoromethyl)butanoateButanoic acid, 4,4,4-trifluoro-3-hydroxy-2-methylene-3-(trifluoromethyl)-,ethyl ester
External Identifiers
RefChem:595093MFCD28137304

Catalog Overview

Ethyl 4,4,4-trifluoro-3-hydroxy-2-methylene-3-(trifluoromethyl)butanoate, identified by CAS 152251-75-7, is a highly fluorinated organic compound. Its molecular structure features an ethyl acrylate moiety alongside a hexafluoroisopropyl alcohol group. This unique combination of a terminal alkene, an ester, and a highly electron-withdrawing fluorinated tertiary alcohol makes it a versatile building block. It is primarily intended for research and development as an intermediate for introducing both trifluoromethyl groups and a reactive acrylate unit into target molecules, suitable for various synthetic transformations in academic...

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Read more catalog context

Ethyl 4,4,4-trifluoro-3-hydroxy-2-methylene-3-(trifluoromethyl)butanoate, identified by CAS 152251-75-7, is a highly fluorinated organic compound. Its molecular structure features an ethyl acrylate moiety alongside a hexafluoroisopropyl alcohol group. This unique combination of a terminal alkene, an ester, and a highly electron-withdrawing fluorinated tertiary alcohol makes it a versatile building block. It is primarily intended for research and development as an intermediate for introducing both trifluoromethyl groups and a reactive acrylate unit into target molecules, suitable for various synthetic transformations in academic and industrial research settings.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

Colorless liquid

Physical State

Liquid

Melting Point

-25.5 °C

Boiling Point

149.7 °C

Density

1.46 g/cm³

Water Solubility

6.95 × 10⁻⁵ mol/L

Flash Point

43.4 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle with appropriate personal protective equipment, including chemical-resistant gloves, eye protection, and a lab coat. Use in a well-ventilated area or certified fume hood to prevent inhalation. Avoid direct contact with skin and eyes. In case of exposure, rinse immediately with plenty of water. Store this research-use chemical in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for comprehensive safety information and handling procedures prior to use.

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