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Basic Information
CAS No.: 14631-45-9
Name: 3-Ethoxypropionitrile
Article Data: 11
Molecular Structure:
Molecular Structure of 14631-45-9 (3-Ethoxypropionitrile)
Formula: C5H9 N O
Molecular Weight: 99.15
Synonyms: Propionitrile,2-ethoxy- (6CI,7CI,8CI); 2-Ethoxypropionitrile
EINECS: 218-393-4
Density: 0.891
Boiling Point: 208°C at 760 mmHg
Flash Point: 84.6°C
Safety: Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and CN−. See also NITRILES.
PSA: 33.02000
LogP: 0.93498
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Chemistry

IUPAC Name: 3-Ethoxypropanenitrile
Synonyms: beta-Ethoxypropionitrile ; 3-Ethoxypropanenitrile ; 3-Ethoxypropionitrile ; 3-Ethoxypropiononitrile
CAS NO: 14631-45-9
Empirical Formula of β-Ethoxypropionitrile (β-Ethoxypropionitrile) : C5H9NO
Molecular Weight of β-Ethoxypropionitrile (β-Ethoxypropionitrile) : 99.1311
Molecular Structure of β-Ethoxypropionitrile (β-Ethoxypropionitrile) :
Index of Refraction: 1.4
Surface Tension: 29.8 dyne/cm
Density: 0.894 g/cm3
Flash Point: 63.9 °C
Enthalpy of Vaporization: 40.74 kJ/mol
Boiling Point: 171 °C at 760 mmHg
Vapour Pressure: 1.43 mmHg at 25°C

Toxicity Data With Reference

 

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 2865mg/kg (2865mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 39(4), Pg. 86, 1974.
mouse LD50 oral 2200mg/kg (2200mg/kg) BEHAVIORAL: EXCITEMENT Toxicology of New Industrial Chemical Substances. English translation of TPKVAL. Vol. 13, Pg. 125, 1973.
rat LD50 oral 2860mg/kg (2860mg/kg) BEHAVIORAL: EXCITEMENT Toxicology of New Industrial Chemical Substances. English translation of TPKVAL. Vol. 13, Pg. 125, 1973.

 

 

Consensus Reports

Cyanide and its compounds are on the Community Right-To-Know List.

Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx and CN−. See also NITRILES.