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Merck
CN

233188

4′-(Trifluoromethyl)acetophenone

98%

Synonym(s):

4-Acetylbenzotrifluoride

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About This Item

Linear Formula:
CF3C6H4COCH3
CAS Number:
709-63-7
Molecular Weight:
188.15
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24853958
EC Number:
211-913-0
Beilstein/REAXYS Number:
1870425
MDL number:
MFCD00000401

Key Documents

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Product Name

4′-(Trifluoromethyl)acetophenone, 98%

InChI key

HHAISVSEJFEWBZ-UHFFFAOYSA-N

InChI

1S/C9H7F3O/c1-6(13)7-2-4-8(5-3-7)9(10,11)12/h2-5H,1H3

SMILES string

CC(=O)c1ccc(cc1)C(F)(F)F

assay

98%

form

solid

bp

79-80 °C/8 mmHg (lit.)

mp

30-33 °C (lit.)

functional group

fluoro
ketone

Quality Level

100

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General description

The enantioselective addition of dialkylzinc to 4′-(trifluoromethyl)acetophenone mediated by 1,2-bis(hydroxycamphorsulfonamido)cyclohexenes in the presence of titanium tetraisopropoxide has been investigated. Phosphorescence emission spectra of 4′-(trifluoromethyl)acetophenone has been studied using pulsed source phosphorimetry.

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H315,H319

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

183.2 °F - closed cup

flash_point_c

84 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
SDBB4550
STBK9330
STBJ4603
S47190V
S47190

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Pulsed source, time resolved phosphorimetry determination of phosphorescence lifetimes.
Harbaugh KF, et al.
Analytical Chemistry, 45(2), 381-382 (1973)
Highly enantioselective addition of dialkylzinc reagents to ketones promoted by titanium tetraisopropoxide.
Yus M, et al.
Tetrahedron Asymmetry, 13(21), 2291-2293 (2002)

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