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4-Ethynylbenzonitrile

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4-Ethynylbenzonitrile Basic information

Product Name:
4-Ethynylbenzonitrile
Synonyms:
  • 4-Cyanophenylacetylene
  • (4-Cyanophenyl)ethyne
  • 1-Cyano-4-ethynylbenzene
  • 4-Ethynylbenzonitrile 97%
  • 4-ETHYNYLBENZONITRILE 97
  • Benzonitrile, 4-ethynyl- (9CI)
  • Benzonitrile, 4-ethynyl-
CAS:
3032-92-6
MF:
C9H5N
MW:
127.14
Product Categories:
  • C8 to C9
  • Cyanides/Nitriles
  • Nitrogen Compounds
Mol File:
3032-92-6.mol
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4-Ethynylbenzonitrile Chemical Properties

Melting point:
156-160 °C(lit.)
Boiling point:
230.2±23.0 °C(Predicted)
Density 
1.037 g/mL at 25 °C(lit.)
Flash point:
>110 °C
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
form 
Solid
color 
Pale yellow
Water Solubility 
Slightly soluble in water.
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Safety Information

Hazard Codes 
Xi,Xn
Risk Statements 
36/37/38-20/21/22
Safety Statements 
26-36
WGK Germany 
3
HS Code 
2926907090
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4-Ethynylbenzonitrile Usage And Synthesis

Uses

4-Ethynylbenzonitrile is used as a synthetic fragment and as a test compound for cross-coupling reactions. It is used in the study of hydrogen bond formation in multifunctional molecules due to the presence of four hydrogen bonding sites. It is also involved in the preparation of 4-[(trimethylsilyl)ethynyl]benzonitrile.

General Description

The water complexes formed with 4-ethynylbenzonitrile (4EBzN) were studied using IR-UV double resonance spectroscopy.

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