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14667-55-1

14667-55-1 structural image
Product Name: Trimethyl-pyrazine
Formula: C7H10N2
Synonyms: Potato pyrazine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description colourless to slightly yellow liquid with a roasted nut, baked potato odour
Solubility soluble in water, oils, organic solvents
Density 0.960-0.990
LogP 0.95
Refractive Index 1.500-1.509
Kovats Retention Index 977 973 973 973 974 966 980 983 978 979.3 980 982 983.2 983.4 975 980 978 974 976 1012 1016 1012 1016 980 983 975 978 985 980 986 992 986 971 980 978 988 990.7 992 967 975 978 981 982 974 975 975 976 981 974 981 970 980 974 974.6 988.1

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
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 P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
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 122.17 g/mol
XLogP3 1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 122.084398327 g/mol
Monoisotopic Mass 122.084398327 g/mol
Topological Polar Surface Area 25.8 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 92.9
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

Trimethylpyrazine is a member of the class of pyrazines that is pyrazine in which three hydrogens at positions 2, 3 and 5 have been replaced by methyl groups. It has a role as a plant metabolite, a flavouring agent, a bacterial metabolite, an animal metabolite and a pheromone.