All Photos(1)
Linear Formula:
CF3CO2CH2CF3
CAS Number:
Molecular Weight:
196.05
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
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.)
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
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.
accessory
Product No.
Description
Pricing
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Flam. Liq. 2 - Skin Corr. 1B
WGK
WGK 3
Flash Point(F)
32.0 °F
Flash Point(C)
0 °C
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
危险化学品
Certificates of Analysis (COA)
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Experimental and theoretical studies of the vibrations and structure of 2, 2, 2-trifluoroethyl trifluoroacetate, CF3CO2CH2CF3.
Defonsi Lestard ME, et al.
Journal of Molecular Structure, 917(2), 183-192 (2009)
A convenient synthesis of dimethyl (diazomethyl) phosphonate (Seyferth/Gilbert reagent).
Brown DG, et al.
The Journal of Organic Chemistry, 61(7), 2540-2541 (1996)
Homogeneous catalytic hydrogenation of carboxylic acid esters to alcohols.
Grey RA, et al.
Journal of the Chemical Society. Chemical Communications, 16, 783-784 (1980)
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