2-Acetyl-3-methylpyrazine

Catalog	ACM23787806
CAS	23787-80-6
Structure
Synonyms	Pyrazine, 2-acetyl-3-methyl
IUPAC Name	1-(3-Methylpyrazin-2-yl)ethanone
Molecular Weight	136.15
Molecular Formula	C7H8N2O
Canonical SMILES	CC1=NC=CN=C1C(=O)C
InChI	InChI=1S/C7H8N2O/c1-5-7(6(2)10)9-4-3-8-5/h3-4H,1-2H3
InChI Key	QUNOTZOHYZZWKQ-UHFFFAOYSA-N
Boiling Point	90 °C
Melting Point	90ºC (20 torr)
Flash Point	176 °F
Purity	98%
Density	1.114 g/mL at 25 °C(lit.)
Solubility	Soluble in water, organic solvents, oils
Appearance	Clear slightly yellow liquid.
Exact Mass	136.063662883
Monoisotopic Mass	136.063662883
Odor	Nutty, roasted grain, baked potato odor
Physical State	Liquid
Refractive Index	n20/D 1.521(lit.)
Storage Conditions	Dark place,inert atmosphere,2-8 °C
Topological Polar Surface Area	42.8 Ų