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2-Methyl-3- (methylthio) pyrazine

CAT: 0024-sc-254277Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-254277Size:1 g
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CAS Number
2882-20-4

Chemical Information

Pyrazine, methyl(methylthio)-

2-Methyl-(3 or 5 or 6)-(methylthio)pyrazine (mixture of isomers) is an aryl sulfide.

CAS Number2882-20-4
PubChem CID76152
IUPAC Name2-methyl-3-methylsulfanylpyrazine
Molecular FormulaC6H8N2S
Molecular Weight140.21
XLogP1.8
Topological Polar Surface Area51.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity87
SMILES
CC1=NC=CN=C1SC
InChI
InChI=1S/C6H8N2S/c1-5-6(9-2)8-4-3-7-5/h3-4H,1-2H3
InChIKey
PPPFFGVGWFKTHX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyrazine, methyl(methylthio)-
CAS: 2882-20-4
CID: 76152
Formula: C6H8N2S
MW: 140.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight140.21
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass140.04081944
Monoisotopic Mass140.04081944
Topological Polar Surface Area51.1 Ų
Heavy Atom Count9
Formal Charge0
Complexity87.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
OR350253-012-Methyl-3- (methylthio) pyrazine
TRC-M355880-500MG2-Methyl-6-(methylthio)pyrazine
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OR1078734-012-Ethyl-3- (methylthio) pyrazine
OR10211362,3-Dichloro-5- (methylthio) pyrazine
OR75569-012-Bromo-5- (methylthio) pyrazine
OR10983642-Chloro-6- (methylthio) pyrazine
OR9318953-Bromo-8- (methylthio) imidazo[1,2-a]pyrazine
OR89464-016-Methyl-8- (methylthio) -3-[1-[[2- (trimethylsilyl) ethoxy]methyl]-1H-pyrazol-4-yl]imidazo[1,2-a]pyrazine
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