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27043-05-6

27043-05-6 structural image
Product Name: 2-Ethyl-3,5-dimethylpyrazine
Formula: C8H12N2
Synonyms: 2-Ethyl-3(5 or 6)-dimethylpyrazine, mixture of isomers
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description colourless to slightly yellow liquid with a toasted nut, chocolaty, sweet woody odour
Boiling Point 180.00 to 182.00 °C. @ 760.00 mm Hg
Solubility soluble in water, oils, organic solvents
Density 0.950-0.980
Refractive Index 1.496-1.506
Kovats Retention Index 1070 1068 1064 1064 1060 1067 1068 1059 1062 1058 1047 1056 1057 1045 1054 1058 1072 1065 1072 1060 1061 1064 1056 1056 1059 1062 1048.8 1059.2

SAFETY INFORMATION

Signal word Warning
Pictogram(s)
GHS07
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.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
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 136.19 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 136.100048391 g/mol
Monoisotopic Mass 136.100048391 g/mol
Topological Polar Surface Area 25.8 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 103
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

2-Ethyl-3,5-dimethylpyrazine is a member of pyrazines.