232025
4-(Trifluoromethyl)benzyl alcohol
98%
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About This Item
Linear Formula:
CF3C6H4CH2OH
CAS Number:
Molecular Weight:
176.14
EC Number:
206-494-6
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
1450174
MDL number:
InChI key
MOOUWXDQAUXZRG-UHFFFAOYSA-N
InChI
1S/C8H7F3O/c9-8(10,11)7-3-1-6(5-12)2-4-7/h1-4,12H,5H2
SMILES string
OCc1ccc(cc1)C(F)(F)F
assay
98%
refractive index
n20/D 1.459 (lit.)
bp
78-80 °C/4 mmHg (lit.)
density
1.286 g/mL at 25 °C (lit.)
General description
Photocatalytic oxidation of 4-(trifluoromethyl)benzyl alcohol to corresponding aldehydes on TiO2 photocatalyst under O2 atmosphere has been reported.
Application
4-(Trifluoromethyl)benzyl alcohol was used:
- in the synthesis of highly electron-poor fluorine-containing alkenes
- as a reagent in kinetic studies of phosphonoformate prodrugs and aquachromium (IV)
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
213.8 °F - closed cup
flash_point_c
101 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Journal of the American Chemical Society, 114, 4205-4205 (1992)
Selective photocatalytic oxidation of benzyl alcohol and its derivatives into corresponding aldehydes by molecular oxygen on titanium dioxide under visible light irradiation.
Higashimoto S, et al.
J. Catal., 266(2), 279-285 (2009)
J. Chem. Soc. Perkin Trans. II, 1145-1145 (1992)
One-pot synthesis of fluorine-containing alkenes from in situ-generated stabilized phosphorus ylides.
Pakravan P, et al.
Phosphorus, Sulfur, and Silicon and the Related Elements, 182(3), 545-549 (2007)
D C Anderson et al.
Biochemistry, 19(24), 5486-5493 (1980-11-25)
The interactions of horse liver alcohol dehydrogenase (LADH) with the rho-trifluoromethyl derivatives of benzyl alcohol, benzaldehyde, and benzoic acid have been investigated by use of 19F nuclear magnetic resonance. The aldehyde and alcohol are good substrates for the enzyme and
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