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Merck
CN

529214

2-Fluoro-4-(trifluoromethyl)benzaldehyde

98%

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About This Item

Linear Formula:
F3CC6H3(F)CHO
CAS Number:
Molecular Weight:
192.11
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
98%
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Product Name

2-Fluoro-4-(trifluoromethyl)benzaldehyde, 98%

InChI

1S/C8H4F4O/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-4H

SMILES string

Fc1cc(ccc1C=O)C(F)(F)F

InChI key

KFEHNXLFIGPWNB-UHFFFAOYSA-N

assay

98%

refractive index

n20/D 1.45 (lit.)

bp

118-119 °C (lit.)

density

1.41 g/mL at 25 °C (lit.)

functional group

aldehyde
fluoro

Application

2-Fluoro-4-(trifluoromethyl)benzaldehyde may be used in the synthesis of methyl 3-amino-6-(trifluoromethyl)benzo[b]thiophene-2-carboxylate.

pictograms

Exclamation mark

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Warning

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

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Yaws CL.
Thermophysical Properties of Chemicals and Hydrocarbons, 548-548 (2014)
Mark C Bagley et al.
Organic & biomolecular chemistry, 13(24), 6814-6824 (2015-05-28)
Microwave irradiation of 2-halobenzonitriles and methyl thioglycolate in the presence of triethylamine in DMSO at 130 °C provides rapid access to 3-aminobenzo[b]thiophenes in 58-96% yield. This transformation has been applied in the synthesis of the thieno[2,3-b]pyridine core motif of LIMK1
Yao Zong et al.
Journal of fluorine chemistry, 203, 193-199 (2018-01-10)
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