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Key Documents

162329

Sigma-Aldrich

3-Fluorotoluene

99%

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About This Item

Linear Formula:
CH3C6H4F
CAS Number:
Molecular Weight:
110.13
Beilstein:
1903631
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

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

Signal Word

Danger

Hazard Statements

Hazard Classifications

Flam. Liq. 2

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

48.2 °F - closed cup

Flash Point(C)

9 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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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