AG00765F

18368-65-5 | 2(1H)-Pyridinethione,4-methyl-

AG00765F

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CAS Number	18368-65-5
Catalog Number	AG00765F(AGN-PC-0KYIEF)
Chemical Name	2(1H)-Pyridinethione,4-methyl-
IUPAC Name	4-methyl-1H-pyridine-2-thione
InChI	InChI=1S/C6H7NS/c1-5-2-3-7-6(8)4-5/h2-4H,1H3,(H,7,8)
InChI Key	KGYJCSZMSPBJFS-UHFFFAOYSA-N
MDL Number	MFCD01860230
Molecular Formula	C6H7NS
Molecular Weight	125.1915
SMILES	SC1=NC=CC(C)=C1
Synonyms	2-Mercapto-4-methylpyridine, 18368-65-5, 4-methylpyridine-2-thiol, 4-Methylpyridine-2(1h)-Thione, 2(1H)-Pyridinethione, 4-methyl-, 4-methyl-1H-pyridine-2-thione, 2(1H)-Pyridinethione,4-methyl-, AC1MVCCL, 4-Methyl-2-pyridthione, 4-Methyl-2-pyridinethiol, SCHEMBL2642944, SCHEMBL9976677, 4-Methyl-2(1H)-pyridinethione, CTK4D8562, DTXSID80394959, KGYJCSZMSPBJFS-UHFFFAOYSA-N, 4-Methyl-2(1H)-pyridinethione #, MFCD00955802, ZINC14983130, 4-Methyl-2-pyridinethiol, AldrichCPR, AKOS010995276, AKOS028111740, AM100424, DB-082036, FT-0724914, Z2760930234, InChI=1/C6H7NS/c1-5-2-3-7-6(8)4-5/h2-4H,1H3,(H,7,8, 4H2, CID3681029,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	125.03g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	125.189g/mol
Monoisotopic Mass	125.03g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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