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2,2,2-Trifluoroethanol

analytical standard, for NMR spectroscopy

Synonym(s):

Trifluoroethyl alcohol

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About This Item

Linear Formula:
CF3CH2OH
CAS Number:
75-89-8
Molecular Weight:
100.04
Beilstein:
1733203
EC Number:
200-913-6
MDL number:
MFCD00004672
UNSPSC Code:
12142201
PubChem Substance ID:
329770066
NACRES:
NA.24

grade

analytical standard
for NMR spectroscopy

Quality Level

100

vapor density

3.5 (vs air)

vapor pressure

70 mmHg ( 25 °C)

Assay

≥99.5% (GC)

autoignition temp.

~896 °F

expl. lim.

42 %

refractive index

n20/D 1.3 (lit.)

bp

77-80 °C (lit.)

mp

−44 °C (lit.)

density

1.373 g/mL at 25 °C (lit.)

application(s)

environmental

format

neat

SMILES string

OCC(F)(F)F

InChI

1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2

InChI key

RHQDFWAXVIIEBN-UHFFFAOYSA-N

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Application

2,2,2-Trifluoroethanol may be used as a co-solvent for the purification of certain alcohol sensitive compounds like boronic acid pinacol esters using supercritical fluid chromatography technique(SFC).

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Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Eye Dam. 1 - Flam. Liq. 3 - Repr. 1B - STOT RE 2 Inhalation

Target Organs

Blood

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

86.0 °F - closed cup

Flash Point(C)

30 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BCBR9147V
BCBQ9809V
BCBK1966V
BCBK2275V
BCBJ8549V

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Applications of 2, 2, 2 trifluoroethanol as a versatile co-solvent in supercritical fluid chromatography for purification of unstable boronate esters, enhancing throughput, reducing epimerization, and for additive free purifications
Asokan K, et al.
Journal of Chromatography A, 1531, 122-130 (2018)
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A facile parallel synthesis of trifluoroethyl-substituted alkynes.
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Angewandte Chemie (International ed. in English), 51(25), 6227-6230 (2012-05-09)
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