Basic information Safety Supplier Related

Ethyl 4-cyanobenzoate

Basic information Safety Supplier Related

Ethyl 4-cyanobenzoate Basic information

Product Name:
Ethyl 4-cyanobenzoate
Synonyms:
  • Benzoic acid, 4-cyano-, ethyl ester
  • P-CYANOBENZOIC ACID ETHYL ESTER
  • RARECHEM AL BI 0074
  • ETHYL 4-CYANOBENZOATE
  • ethyl cyanobenzoate
  • Ethyl 4-cyanobenzoate,99%
  • 4-CYANOBENZOIC ACID ETHYL ESTER
  • Ethyl 4-cyanobenzoate 99%
CAS:
7153-22-2
MF:
C10H9NO2
MW:
175.18
EINECS:
230-500-6
Product Categories:
  • FINE Chemical & INTERMEDIATES
  • Aromatic Esters
  • Building Blocks
  • C10 to C11
  • Carbonyl Compounds
  • Chemical Synthesis
  • Organic Building Blocks
  • C10 to C11
  • Carbonyl Compounds
  • Esters
Mol File:
7153-22-2.mol
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Ethyl 4-cyanobenzoate Chemical Properties

Melting point:
52-54 °C (lit.)
Boiling point:
140°C/11mmHg(lit.)
Density 
1.1999 (rough estimate)
refractive index 
1.5060 (estimate)
Flash point:
>230 °F
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
solubility 
soluble in Methanol
form 
powder to crystal
color 
White to Almost white
λmax
263nm(lit.)
CAS DataBase Reference
7153-22-2(CAS DataBase Reference)
NIST Chemistry Reference
Ethyl 4-cyanobenzoate(7153-22-2)
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Safety Information

Hazard Codes 
Xn,Xi
Risk Statements 
20/21/22-36/37/38
Safety Statements 
26-36-36/37/39
WGK Germany 
3
HazardClass 
IRRITANT
HS Code 
29269090

MSDS

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Ethyl 4-cyanobenzoate Usage And Synthesis

Chemical Properties

white to light yellow crystalline powder

Synthesis

64-17-5

105-07-7

7153-22-2

General procedure for the synthesis of ethyl 4-cyanobenzoate from ethanol and 4-cyanobenzaldehyde: 4-cyanobenzaldehyde (25 mmol), [bmim]N3 (75 mmol) and ethanol (75 mmol) were thoroughly mixed and the reaction was stirred at 50-60 °C. The reaction process was monitored by thin layer chromatography (TLC) using ethyl acetate/petroleum ether (1:7) as eluent. After completion of the reaction, the target product ethyl 4-cyanobenzoate was isolated by preparative chromatography using ethyl acetate/petroleum ether as eluent.

References

[1] Synthesis, 2010, # 2, p. 276 - 282
[2] Comptes Rendus Chimie, 2012, vol. 15, # 11-12, p. 1077 - 1080
[3] Bulletin of the Korean Chemical Society, 2011, vol. 32, # 6, p. 2070 - 2072
[4] Journal of Organometallic Chemistry, 2018, vol. 857, p. 123 - 137

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