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235822

3-Fluorobenzonitrile

98%

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About This Item

Linear Formula:
FC6H4CN
CAS Number:
403-54-3
Molecular Weight:
121.11
NACRES:
NA.22
PubChem Substance ID:
24854117
UNSPSC Code:
12352100
EC Number:
206-963-5
MDL number:
MFCD00001797
Assay:
98%
Form:
liquid
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assay

98%

form

liquid

refractive index

n20/D 1.5043 (lit.)

bp

182-183 °C/753 mmHg (lit.)

mp

−16 °C (lit.)

density

1.133 g/mL at 25 °C (lit.)

functional group

fluoro, nitrile

SMILES string

Fc1cccc(c1)C#N

InChI

1S/C7H4FN/c8-7-3-1-2-6(4-7)5-9/h1-4H

InChI key

JZTPKAROPNTQQV-UHFFFAOYSA-N

General description

Microwave spectrum of 3-fluorobenzonitrile has been studied. Amination of 3-fluorobenzonitrile with morpholine in DMSO at 100°C has been investigated.

Application

3-Fluorobenzonitrile has been used in the preparation of bis(3-cyanophenoxy)phenylenes.

pictograms

CorrosionExclamation mark
GHS05,GHS07

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

154.4 °F - closed cup

flash_point_c

68 °C - closed cup

ppe

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

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