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Ethyl 4-cyanobenzoate Structure

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.)
InChI 1S/C10H9NO2/c1-2-13-10(12)9-5-3-8(7-11)4-6-9/h3-6H,2H2,1H3
InChIKey JLSSWDFCYXSLQX-UHFFFAOYSA-N
SMILES CCOC(=O)c1ccc(cc1)C#N
CAS DataBase Reference 7153-22-2(CAS DataBase Reference)
NIST Chemistry Reference Ethyl 4-cyanobenzoate(7153-22-2)

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
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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