Ethyl cyanoacetate CAS#105-56-6

  • CAS Number:  105-56-6

  • Chemical Formula:  C5H7NO2

  • Synonyms:

    • Ethylester kyseliny kyanoctove

    • 2-cyano-aceticacidethylester

    • Acetic acid,2-cyano-, ethyl ester

    Appearance: White Powder

  • MOQ (Minimum Order Quantity): 1 FCL (Full Container Load)



Product Details

Ethyl cyanoacetate CAS#105-56-6

Ethyl cyanoacetate is the ethyl ester of cyanoacetic acid. Ethyl cyanoacetate hydrolizes rapidly under neutral and alkaline conditions to cyanoacetic acid and ethanol (and so it does under most physiological and environmental conditions), while in acid pH the half life is considerably longer.
Knoevenagel condensation of ethyl cyanoacetate with aldehyde is reported. Microwave enhanced Knoevenegal condensation reaction of ethyl cyanoacetate with an aldehyde, P2O5, piperidine and chlorobenzene is reported.

Ethyl cyanoacetate Chemical Properties

Melting point 

-22 °C (lit.)

Boiling point 

208-210 °C (lit.)

density 

1.063 g/mL at 25 °C (lit.)

vapor density 

3.9 (vs air)

vapor pressure 

1 mm Hg ( 67.8 °C)

refractive index 

n20/D 1.418(lit.)

Fp 

>230 °F

storage temp. 

Store below +30°C.

solubility 

20g/l

pka

3.19±0.10(Predicted)

form 

Liquid

color 

Clear

Water Solubility 

20 g/L (20 ºC)

Merck 

14,3786

BRN 

605871

Dielectric constant

26.9(20℃)

InChI

1S/C5H7NO2/c1-2-8-5(7)3-4-6/h2-3H2,1H3

InChIKey

ZIUSEGSNTOUIPT-UHFFFAOYSA-N

SMILES

CCOC(=O)CC#N

LogP

-0.119-1.05 at 23-25℃ and pH6.1

Surface tension

70.2mN/m at 1.034g/L and 23℃

CAS DataBase Reference

105-56-6(CAS DataBase Reference)

NIST Chemistry Reference

Acetic acid, cyano-, ethyl ester(105-56-6)

EPA Substance Registry System

Ethyl cyanoacetate (105-56-6)


Safety Information

Hazard Codes 

Xn,Xi

Risk Statements 

20/21/22-36/38

Safety Statements 

36/37-37/39-26

RIDADR 

3276

WGK Germany 

1

RTECS 

AG4110000

10

Autoignition Temperature

460 °C

TSCA 

TSCA listed

HS Code 

2926 90 70

Storage Class

10 - Combustible liquids

Hazard Classifications

Eye Irrit. 2

Hazardous Substances Data

105-56-6(Hazardous Substances Data)

Toxicity

LD50 orally in Rabbit: > 2000 mg/kg


Product Application of Ethyl cyanoacetate CAS#105-56-6

Reagent used in labelled pyrimidine and purine synthesis. Ethyl cyanoacetate is an ester. It may be used in the synthesis of ethyl glyoxylate.It was used to investigate the Knoevenagel condensation reactions in microreactor using zeolite catalysts obtained by grafting amino groups onto NaX and CsNaX zeolites.


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