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107-29-9

107-29-9 structural image
Product Name: Acetaldoxime
Formula: C2H5NO
Synonyms: Acetaldehyde oxim;Acetaldoxime
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Acetaldehyde oxime appears as a colorless liquid with a pungent odor. Has two crystalline modifications, one melting at 12 °C and the other at 46.5 °C.
Color/Form Needles
Boiling Point 115 °C
Melting Point 45 °C
Flash Point Flash point < 22 °C
Solubility Very soluble in water
Density 0.9656 at 20 °C/4 °C
Vapor Pressure 7.71 [mmHg]
LogP log Kow = -0.13
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxides/.
Heat of Combustion -1.3201X10+9 J/kmol /Standard Net Heat of Combustion/
Heat of Vaporization 49.03 kJ/mol
Odor Threshold Odor Threshold Low: 1.0 [mmHg] [HSDB] Odor threshold from IUCLID
Refractive Index Index of refraction: 1.415 at 20 °C/D
Other Experimental Properties Hydrolyzes to acetaldehyde and hydroxylamine by treatment with aqueous hydrochloric acid
Chemical Classes Nitrogen Compounds -> Oximes

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 59.07 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 59.037113783 g/mol
Monoisotopic Mass 59.037113783 g/mol
Topological Polar Surface Area 32.6 Ų
Heavy Atom Count 4
Formal Charge 0
Complexity 25.2
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Acetaldehyde oxime appears as a colorless liquid with a pungent odor. Has two crystalline modifications, one melting at 12 °C and the other at 46.5 °C.

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