AG003H6Z

72987-62-3 | 2-(METHYLTHIO)-3-ETHYLPYRAZINE

AG003H6Z

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CAS Number	72987-62-3
Catalog Number	AG003H6Z(AGN-PC-0JNDGT)
Chemical Name	2-(METHYLTHIO)-3-ETHYLPYRAZINE
EC Number	277-191-4
FEMA Number	4631
IUPAC Name	2-ethyl-3-methylsulfanylpyrazine
InChI	InChI=1S/C7H10N2S/c1-3-6-7(10-2)9-5-4-8-6/h4-5H,3H2,1-2H3
InChI Key	XYHPPOMSLGJAAM-UHFFFAOYSA-N
MDL Number	MFCD00038027
Molecular Formula	C7H10N2S
Molecular Weight	154.2327
SMILES	C1(SC)C(CC)=NC=CN=1
UNII	D7F04498AY
Synonyms	2-Ethyl-3-(methylthio)pyrazine, 72987-62-3, 2-(Methylthio)-3-ethylpyrazine, 3-ethyl-2-methylthiopyrazine, 2-Ethyl-3-methylthiopyrazine, Pyrazine, 2-ethyl-3-(methylthio)-, UNII-D7F04498AY, 2-ethyl-3-methylsulfanylpyrazine, 2-ethyl-3-methylsulfanyl-pyrazine, D7F04498AY, 2-Ethyl-3-(methylsulfanyl)pyrazine, 2-METHYLTHIO-3-ETHYLPYRAZINE, W-104470, EINECS 277-191-4, ACMC-1BFO4, SCHEMBL301725, 2-ethyl-3-methyl thiopyrazine, 2-ethyl-3-methylthio pyrazine, 2-methylthio-3-ethyl pyrazine, AC1L41H8, 3-ethyl-2-(methylthio)pyrazine, DTXSID7072701, CTK5D7204, XYHPPOMSLGJAAM-UHFFFAOYSA-N, Pyrazine, 3-ethyl-2-(methylthio), Pyrazine,2-ethyl-3-(methylthio)-, ZINC2575508, 2-Ethyl-3-methylthiopyrazine, 97%, ANW-36271, FCH920334, MFCD00038027, 2-methylthio-3(5/6)-ethyl pyrazine, 2-Ethyl-3-(methylsulfanyl)pyrazine #, AKOS006343700, FS-1048, MCULE-3815980224, VP40068, 2-Ethyl-3-(methylthio)pyrazine , 98%, AN-37385, CC-14987, DB-055708, TR-023757, E0719, FT-0641437, ST51041403, 987M623, A837688, C-03359, I14-1007, C7H10N2S, C7-H10-N2-S, CID175366, ZINC02575508,

Complexity	97.6
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.056g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.231g/mol
Monoisotopic Mass	154.056g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
UN Code

Certificate of Analysis

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