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Trimethyl-pyrazine Structure

Trimethyl-pyrazine

Chemical Properties

Melting point 156 °C
Boiling point 171-172 °C (lit.)
Density  0.979 g/mL at 25 °C (lit.)
FEMA  3244 | 2,3,5-TRIMETHYLPYRAZINE
refractive index  n20/D 1.5040(lit.)
Flash point 130 °F
storage temp.  Inert atmosphere,Room Temperature
solubility  Chloroform (Slightly)
pka 2.69±0.10(Predicted)
form  Liquid
Specific Gravity 0.979
color  Colorless to Light yellow to Light orange
Odor roasted odor, reminiscent of coffee and cocoa
Odor Type nutty
biological source synthetic
JECFA Number 774
BRN  2423
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C7H10N2/c1-5-4-8-6(2)7(3)9-5/h4H,1-3H3
InChIKey IAEGWXHKWJGQAZ-UHFFFAOYSA-N
SMILES Cc1cnc(C)c(C)n1
LogP 1.10
CAS DataBase Reference 14667-55-1(CAS DataBase Reference)
NIST Chemistry Reference Pyrazine, trimethyl-(14667-55-1)
EPA Substance Registry System Trimethylpyrazine (14667-55-1)

Safety Information

Hazard Codes  Xn
Risk Statements  10-22-36/37/38
Safety Statements  16-26-36/37/39
RIDADR  UN 1993 3/PG 3
WGK Germany  3
RTECS  UQ3907000
TSCA  TSCA listed
HazardClass  3
PackingGroup  III
HS Code  29339900
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
Toxicity rat,LD50,oral,806mg/kg (806mg/kg),Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.

MSDS

Usage And Synthesis

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