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Merck
CN

152692

4-Bromobenzotrifluoride

99%

Synonym(s):

1-Bromo-4-(trifluoromethyl)benzene, 4-Bromo-α,α,α-trifluorotoluene

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About This Item

Linear Formula:
BrC6H4CF3
CAS Number:
402-43-7
Molecular Weight:
225.01
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24849250
EC Number:
206-943-6
Beilstein/REAXYS Number:
2045666
MDL number:
MFCD00000398

Key Documents

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Product Name

4-Bromobenzotrifluoride, 99%

InChI key

XLQSXGGDTHANLN-UHFFFAOYSA-N

InChI

1S/C7H4BrF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H

SMILES string

FC(F)(F)c1ccc(Br)cc1

assay

99%

form

liquid

refractive index

n20/D 1.472 (lit.)

bp

154-155 °C (lit.)

density

1.607 g/mL at 25 °C (lit.)

functional group

bromo
fluoro

Quality Level

100

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Application

4-Bromobenzotrifluoride was used to study the catalytic activity of palladacycle using Suzuki-Miyaura reaction.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

120.2 °F - closed cup

flash_point_c

49 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
SDBB5505
SDBB0350
STBK7809
STBK9526
STBK4126

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Development of a fluorous, oxime-based palladacycle for microwave-promoted carbon?carbon coupling reactions in aqueous media.
Green Chemistry, 14(1), 77-80 (2012)
Xiao Yan et al.
Physical chemistry chemical physics : PCCP, 22(11), 6222-6230 (2020-03-05)
Unveiling the reaction mechanism is significant for developing high-performance catalysts. In this paper, a series of precisely controlled PdxM147-x (M = Cu, Pt, Au, Rh, Ru) dendrimer encapsulated nanoparticles (DENs) has been successfully synthesized. The mechanisms of PdxM147-x as catalysts

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