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127-06-0

127-06-0 structural image
Product Name: Acetone oxime
Formula: C3H7NO
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Crystals with a chloral odor; [Hawley] White powder; [Alfa Aesar MSDS]
Color/Form Columnar prisms
Boiling Point 133 °C
Melting Point 61 °C
Solubility In water, 30.0 to 32.7% w/w at 20.0 °C
Density Density: 0.9113 g/cm cu at 62 °C
Vapor Pressure 3.12 [mmHg]
LogP log Kow = 0.12
Stability/Shelf Life Stable under recommended storage conditions.
Decomposition Hazardous decomposition products formed under fire conditions. - Carbon oxides, Nitrogen oxides (NOx)
Refractive Index Refractive index = 1.4156 at 20 °C
Dissociation Constants pK = 12.42 at 24.9 °C
Kovats Retention Index 700
Other Experimental Properties log Kow = 0.077 (Kow = 1.19) at 22.7 °C
Chemical Classes Nitrogen Compounds -> Oximes

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08
GHS Hazard Statements H228:Flammable solids
H312:Acute toxicity,dermal
H317:Sensitisation, Skin
H318:Serious eye damage/eye irritation
H351:Carcinogenicity
Precautionary Statement Codes P201:Obtain special instructions before use.
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 73.09 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 73.052763847 g/mol
Monoisotopic Mass 73.052763847 g/mol
Topological Polar Surface Area 32.6 Ų
Heavy Atom Count 5
Formal Charge 0
Complexity 44.9
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

Acetone oxime is a ketoxime.