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Sigma-Aldrich

3-Fluorotoluene

99%

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About This Item

Linear Formula:
CH3C6H4F
CAS Number:
352-70-5
Molecular Weight:
110.13
Beilstein/REAXYS Number:
1903631
EC Number:
206-524-8
MDL number:
MFCD00000339
UNSPSC Code:
12352100
PubChem Substance ID:
24849978
NACRES:
NA.22

Quality Level

100

assay

99%

form

liquid

refractive index

n20/D 1.469 (lit.)

bp

115 °C (lit.)

mp

−87 °C (lit.)

density

0.991 g/mL at 25 °C (lit.)

SMILES string

Cc1cccc(F)c1

InChI

1S/C7H7F/c1-6-3-2-4-7(8)5-6/h2-5H,1H3

InChI key

BTQZKHUEUDPRST-UHFFFAOYSA-N

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General description

Reaction of 3-fluorotoluene with excesses of methanol has been investigated on the large-pore catalysts and on the medium-pore HZSM-5.

Application

3-Fluorotoluene was used in gas phase selective synthesis of 3-fluorobenzaldehyde. It was used in generation of tolyl cations by chemical ionization in mass spectrometry.

pictograms

Flame
GHS02

signalword

Danger

hcodes

H225

Hazard Classifications

Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk_germany

WGK 2

flash_point_f

48.2 °F - closed cup

flash_point_c

9 °C - closed cup

ppe

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

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Vapor phase oxidation of 4-fluorotoluene over vanadia-titania catalyst.
Maurya SK, et al.
J. Mol. Catal. A: Chem., 234(1), 51-57 (2005)
David M Marcus et al.
Langmuir : the ACS journal of surfaces and colloids, 20(14), 5946-5951 (2006-02-08)
The reactions of fluorobenzene, 3-fluorotoluene, and three isomers of difluorotoluene, chlorobenzene, and bromobenzene with excesses of methanol were investigated on the large-pore catalysts HBeta (*BEA) and HSAPO-5 (AFI), and on the medium-pore HZSM-5 (MFI). Flow reactor studies in pulse mode
T G Heath et al.
Journal of the American Society for Mass Spectrometry, 2(4), 270-277 (1991-08-01)
The ion/molecule reaction of the tolyl cation with dimethyl ether has been investigated using triple quadrupole mass spectrometry. Three isomers with [C7H7](+) composition, the 3-tolyl, benzyl, and tropylium cations, were individually selected and reacted with dimethyl ether at a pressure

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