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13246-52-1

13246-52-1 structural image
Product Name: ETHYL PROPIONYL PYRUVATE
Formula: C8H12O4
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CHEMICAL AND PHYSICAL PROPERTIES

Boiling Point 100.00 to 105.00 °C. @ 6.00 mm Hg
Density 1.103-1.109
Refractive Index 1.477-1.482

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
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 172.18 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 172.07355886 g/mol
Monoisotopic Mass 172.07355886 g/mol
Topological Polar Surface Area 60.4 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 195
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 2,4-dioxohexanoate is a 3-acylpyruvic acid.