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B59004

Sigma-Aldrich

3-Bromobenzotrifluoride

99%

Synonym(s):

1-Bromo-3-(trifluoromethyl)benzene, 3-Bromo-α,α,α-trifluorotoluene

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About This Item

Linear Formula:
BrC6H4CF3
CAS Number:
401-78-5
Molecular Weight:
225.01
Beilstein/REAXYS Number:
1449557
EC Number:
206-932-6
MDL number:
MFCD00000380
UNSPSC Code:
12352100
PubChem Substance ID:
24891876
NACRES:
NA.22

Quality Level

100

assay

99%

form

liquid

refractive index

n20/D 1.473 (lit.)

bp

151-152 °C (lit.)

density

1.613 g/mL at 25 °C (lit.)

SMILES string

FC(F)(F)c1cccc(Br)c1

InChI

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

InChI key

NNMBNYHMJRJUBC-UHFFFAOYSA-N

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pictograms

Flame
GHS02

signalword

Warning

hcodes

H226

pcodes

P210

Hazard Classifications

Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

109.4 °F - closed cup

flash_point_c

43 °C - closed cup

ppe

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

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Certificates of Analysis (COA)

Lot/Batch Number
STBK5037
STBJ9456
STBH2721
STBG8341
STBG6232

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