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2-ethyl-5-methylpyrazine

CAS No.:
13360-64-0
Catalog Number:
AG003646
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
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Product Description
Catalog Number:
AG003646
Chemical Name:
2-ethyl-5-methylpyrazine
CAS Number:
13360-64-0
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
MDL Number:
MFCD09039261
IUPAC Name:
2-ethyl-5-methylpyrazine
InChI:
InChI=1S/C7H10N2/c1-3-7-5-8-6(2)4-9-7/h4-5H,3H2,1-2H3
InChI Key:
OXCKCFJIKRGXMM-UHFFFAOYSA-N
SMILES:
CCc1cnc(cn1)C
EC Number:
236-416-6
UNII:
W41R8X574D
FEMA Number:
3154
Properties
Complexity:
83  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.171g/mol
Monoisotopic Mass:
122.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
An in vitro evaluation of the effect of probiotics and prebiotics on the metabolic profile of human microbiota. Anaerobe 20120801
Identification of potent odourants in wine and brewed coffee using gas chromatography-olfactometry and comprehensive two-dimensional gas chromatography. Journal of chromatography. A 20111021
Identification of tartary buckwheat tea aroma compounds with gas chromatography-mass spectrometry. Journal of food science 20110801
Comparison of fermented soybean paste (Doenjang) prepared by different methods based on profiling of volatile compounds. Journal of food science 20110401
Properties