292095

2,2,2-Trifluoroethyl trifluoroacetate

≥95%

• Linear Formula: CF₃CO₂CH₂CF₃
• CAS Number: 407-38-5
• Molecular Weight: 196.05
• EC Number: 206-985-5
• MDL number: MFCD00000418
• UNSPSC Code: 12352100
• PubChem Substance ID: 24857558
• NACRES: NA.22

Properties

• vapor pressure: 3.34 psi ( 20 °C)
• Assay: ≥95%
• refractive index: n20/D 1.277 (lit.)
• bp: 55 °C (lit.)
• density: 1.464 g/mL at 25 °C (lit.)
• functional group: ester; fluoro
• SMILES string: FC(F)(F)COC(=O)C(F)(F)F
• InChI: 1S/C4H2F6O2/c5-3(6,7)1-12-2(11)4(8,9)10/h1H2
• InChI key: ZKUJOCJJXCPCFS-UHFFFAOYSA-N

Description

General description

The molecular structure of 2,2,2-trifluoroethyl trifluoroacetate has been determined in the gas-phase from electron-diffraction data supplemented by ab initio (MP2) and DFT calculations. Hydrogenation of 2,2,2-trifluoroethyl trifluoroacetate catalyzed by anionic tris-phosphine ruthenium hydride complex has been reported.

Application

2,2,2-Trifluoroethyl trifluoroacetate has been used in the preparation of dimethyl (3,3,3-trifluoro-2,2-dihydroxypropyl)phosphonate.

Safety Information

• Pictograms: GHS02,GHS05
• Signal Word: Danger
• Hazard Statements: H225,H314
• Precautionary Statements: P210 - P233 - P240 - P280 - P303 + P361 + P353 - P305 + P351 + P338
• Hazard Classifications: Flam. Liq. 2 - Skin Corr. 1B
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 3
• Flash Point(F): 32.0 °F - closed cup
• Flash Point(C): 0 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves