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2-Fluorobenzonitrile

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2-Fluorobenzonitrile Basic information

Product Name:
2-Fluorobenzonitrile
Synonyms:
  • 2-Fluorocyanobenzene
  • 2-Fluorophenyl Cyanide
  • NSC 88278
  • A nitrile o-fluorobenzene
  • Nitrile o-fluorobenzene
  • 2-Fluorobenzenenitrile
  • O-Fluorobenzonitile
  • 2-Fluorobenzonitrile, 99% 25GR
CAS:
394-47-8
MF:
C7H4FN
MW:
121.11
EINECS:
206-897-7
Product Categories:
  • Aromatics
  • Miscellaneous Reagents
  • FINE Chemical & INTERMEDIATES
  • Aromatic Nitriles
  • Fluorobenzene
  • Nitrile
  • Fluorobenzene Series
  • Fluorine Compounds
  • Nitriles
  • C6 to C7
  • Cyanides/Nitriles
  • Nitrogen Compounds
  • OLED
Mol File:
394-47-8.mol
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2-Fluorobenzonitrile Chemical Properties

Melting point:
-13.7 °C
Boiling point:
90 °C21 mm Hg(lit.)
Density 
1.116 g/mL at 25 °C(lit.)
refractive index 
n20/D 1.505(lit.)
Flash point:
165 °F
storage temp. 
Sealed in dry,Room Temperature
solubility 
Chloroform
form 
Liquid
color 
Clear colorless to light brownish
Water Solubility 
Insoluble
BRN 
2042184
InChIKey
GDHXJNRAJRCGMX-UHFFFAOYSA-N
CAS DataBase Reference
394-47-8(CAS DataBase Reference)
NIST Chemistry Reference
Benzonitrile, 2-fluoro-(394-47-8)
EPA Substance Registry System
Benzonitrile, 2-fluoro- (394-47-8)
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Safety Information

Hazard Codes 
Xn,T,Xi
Risk Statements 
22-37/38-41-36/37/38-20/21/22
Safety Statements 
26-39-36/37/39-36
RIDADR 
3276
WGK Germany 
3
Hazard Note 
Toxic
TSCA 
T
HazardClass 
IRRITANT, IRRITANT-HARMFUL
PackingGroup 
III
HS Code 
29269095

MSDS

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2-Fluorobenzonitrile Usage And Synthesis

Synthesis

Tetramethylammonium fluoride (TMAF) has been found to be an effective fluorodenitration reagent. The good selectivity for the fluoroaromatic and not the phenol has been attributed to the stability of ion pairing between nitrite and tetramethylammonium ions. TMAF reacts with 2-nitrobenzonitrile to give a quantitative conversion to 2-fluorobenzonitrile.

Chemical Properties

colorless to light yellow liquid

Uses

2-Fluorobenzonitrile, also known as o-fluorobenzonitrile, is an organic aromatic fluoride. It has a wide range of applications in pharmaceuticals, pesticides, dyestuffs, etc. In the field of dyestuff, the introduction of fluorine atom makes the dyed products bright and colorful and less likely to fade, among other advantages.

Uses

2-Fluorobenzonitrile was used in the synthesis of :
3-amino-1,2-benzisoxazoles
6-(acetylaminomethyl)-3-amino-1,2-benzisoxazole
5-(4′-methyl [1, 1′-biphenyl]-2-yl)-1H-tetrazole
xanthone-iminium triflates

General Description

2-Fluorobenzonitrile reacts with lithium N,N-dialkylaminoborohydride reagent to yield 2-(N,N-dialkylamino)benzylamines.

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