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625-58-1

625-58-1 structural image
Product Name: Ethyl nitrate
Formula: C2H5NO3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Ethyl nitrate appears as a clear colorless liquid with a pleasant odor. Prolonged exposure to fire or heat may cause vigorous decomposition and rupturing of the container. Denser than water and insoluble in water. Vapors are heavier than air. Produces toxic oxides of nitrogen during combustion.
Color/Form Colorless liquid
Odor Pleasant odor
Taste Sweet taste
Boiling Point 87.2 °C @ 762 mm Hg
Melting Point -94.6 °C
Flash Point 50 °F (NFPA, 2010)
Solubility Sol in alcohol and ether; insoluble in water
Density 1.1084 @ 20 °C/4 °C
Vapor Density 3.1 (Air= 1)
Vapor Pressure 64.0 [mmHg]
Decomposition On decomp, they emit toxic fumes. /Nitrates/
Heat of Combustion 322.4 kcal (vapor)
Refractive Index Index of refraction: 1.3852 @ 20 °C
Kovats Retention Index 611.9
Other Experimental Properties 1 MG/L= 269 PPM; 1 PPM= 3.72 MG/CU M @ 25 °C, 760 MM HG
Chemical Classes Nitrogen Compounds -> Nitrates and Nitrites

COMPUTED DESCRIPTORS

Molecular Weight 91.07 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 91.026943022 g/mol
Monoisotopic Mass 91.026943022 g/mol
Topological Polar Surface Area 55 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 47.2
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Ethyl nitrate appears as a clear colorless liquid with a pleasant odor. Prolonged exposure to fire or heat may cause vigorous decomposition and rupturing of the container. Denser than water and insoluble in water. Vapors are heavier than air. Produces toxic oxides of nitrogen during combustion.