CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless to slightly yellow liquid |
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Boiling Point | 74.00 to 75.00 °C. @ 20.00 mm Hg |
Solubility | very slightly |
Density | 0.990-1.010 |
Refractive Index | 1.410-1.416 |
Kovats Retention Index | 857 852 856 855 856 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H227:Flammable liquids H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P403+P235:Store in a well-ventilated place. Keep cool. |
COMPUTED DESCRIPTORS
Molecular Weight | 130.14 g/mol |
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XLogP3 | 0.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 130.062994177 g/mol |
Monoisotopic Mass | 130.062994177 g/mol |
Topological Polar Surface Area | 43.4 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 128 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Acetoin acetate is a carboxylic ester and a ketone.