AG002B5K

1979-98-2 | 4(3H)-Pyrimidinone, 6-hydroxy-2-(methylthio)-

AG002B5K

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CAS Number	1979-98-2
Catalog Number	AG002B5K(AGN-PC-0O6S41)
Chemical Name	4(3H)-Pyrimidinone, 6-hydroxy-2-(methylthio)-
EC Number	217-839-5
IUPAC Name	4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one
InChI	InChI=1S/C5H6N2O2S/c1-10-5-6-3(8)2-4(9)7-5/h2H,1H3,(H2,6,7,8,9)
InChI Key	AEXCUJUYEZIWJV-UHFFFAOYSA-N
MDL Number	MFCD00006087
Molecular Formula	C5H6N2O2S
Molecular Weight	158.1783
NSC Number	44557
SMILES	S(C)c1[nH]c(=O)cc(n1)O
Synonyms	1979-98-2, 4,6-Dihydroxy-2-methylthiopyrimidine, 2-(methylthio)pyrimidine-4,6-diol, S-Methylthiobarbituric Acid, 4,6-Dihydroxy-2-methylmercaptopyrimidine, 4,6-Dihydroxy-2-(methylthio)pyrimidine, 2-Methylthiopyrimidine-4,6-diol, 4,6-Dihydroxy-2-methythiopyrimidine, 4,6-dihydroxy-2-methylthio pyrimidine, 2-(methylsulfanyl)pyrimidine-4,6-diol, 2-methylthio-4,6-pyrimidinediol, 6-hydroxy-2-(methylthio)pyrimidin-4(3H)-one, MFCD00006087, 4(1H)-Pyrimidinone, 6-hydroxy-2-(methylthio)-, AEXCUJUYEZIWJV-UHFFFAOYSA-N, 2-(methylthio)-4,6-pyrimidinediol, 2-methylthio-4,6-dihydroxypyrimidine, 2-Methylsulfanyl-pyrimidine-4,6-diol, 4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one, 4,6-DIHYDROXY-2-METHYL-MERCAPTOPYRIMIDINE, 4-HYDROXY-2-(METHYLTHIO)1H-PYRIMIDIN-6-ONE, 6-hydroxy-2-(methylsulfanyl)-3,4-dihydropyrimidin-4-one, 4,6-Dihydroxy-2-meththiopyrimidine, 4,6-Dihydroxy-2-methylmercaptopyrimidine, 97%, s-mtba, NSC44557, EINECS 217-839-5, 2-methylmercapto-4,6-dihydroxypyrimidine, PubChem21501, PubChem22011, AC1L2MOA, AC1Q6BUC, Maybridge4_004721, SCHEMBL117000, CTK4G3599, KS-00000DXU, DTXSID90173499, HMS1579K14, ACT01597, CS-D1586, ANW-45326, NSC-44557, RW1175, SBB057052, ZINC12371919, 4,6-dihydroxy-2-methylmercaprimidine, AKOS002237829, AKOS006242756, 2-(methylmercapto)-4,6-pyrimidinediol, 2-(Methylsulfanyl)-4,6-pyrimidinediol, AC-2561, AS-5210, CD-1025, MCULE-5254557731, RP22178, SDCCGMLS-0064589.P001, 2-(Methylsulphanyl)pyrimidine-4,6-diol, 2-(Methylthio)-4,6-dihydroxypyrimidine, 2-Methylthio-4,6-pyrimidinedione, 97%, NCGC00175598-01, AJ-61927, AK-29103, AN-13858, BC203884, BR-29103, HC210036, HC210395, SC-17527, SY002042, 2-(Methylsulfanyl)-4,6-pyrimidinediol #, 4,6-dihydroxy-2-methylmercapto pyrimidine, 4,6-Dihydroxy-2-(methylmercapto)pyrimidine, 4,6-dihydroxy-2-methyl mercapto pyrimidine, AB0002415, AB0008322, AB1001301, DB-006598, ST2409397, TC-134071, AM20090392, FT-0080167, FT-0601040, FT-0648934, M1013, ST50101852, MFCD00006087 (97%), 4,6(1H,5H)-Pyrimidinedione,2-(methylthio)-, 4-Hydroxy-2-(methylthio)pyrimidin-6(1H)-one, 6-hydroxy-2-(methylthio)-4(1H)-pyrimidinone, 6-hydroxy-2-(methylthio)-4(3H)-Pyrimidinone, 6-hydroxy-2-methylthio-3-hydropyrimidin-4-one, M-3050, X-4397, 4(3H)-Pyrimidinone, 6-hydroxy-2-(methylthio)-, 6-hydroxy-2-(methylsulfanyl)-1H-pyrimidin-4-one, 6-hydroxy-2-(methylsulfanyl)-3H-pyrimidin-4-one, AE-848/30739007, I03-0146, I03-0431, J-514159, W-107676, BRD-K07737811-001-01-2, 2-Methylthio-4,6-pyrimidinedione, C5H6N2O2S, 29639-68-7, C5-H6-N2-O2-S, CID74795, AR-1C9517, RW1522, 4,6-dihydroxy-2-methyl mercaptopyrimidine, A5506, 2-(methylthio)pyrimidine-4,6(1H,5H)-dione, A18401, 2-Methylthio-4,6-pyrimidinedione, 98% - 100G 100g, 30459-51-9,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.015g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	158.175g/mol
Monoisotopic Mass	158.015g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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