AG003F3T

5751-20-2 | 2-(methylsulfanyl)-3,4-dihydropyrimidin-4-one

AG003F3T

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CAS Number	5751-20-2
Catalog Number	AG003F3T(AGN-PC-0OCKZN)
Chemical Name	2-(methylsulfanyl)-3,4-dihydropyrimidin-4-one
EC Number	227-274-6
IUPAC Name	2-methylsulfanyl-1H-pyrimidin-6-one
InChI	InChI=1S/C5H6N2OS/c1-9-5-6-3-2-4(8)7-5/h2-3H,1H3,(H,6,7,8)
InChI Key	UYHSQVMHSFXUOA-UHFFFAOYSA-N
MDL Number	MFCD00047373
Molecular Formula	C5H6N2OS
Molecular Weight	142.1789
SMILES	S(C)c1[nH]c(=O)ccn1
Synonyms	5751-20-2, 2-(methylthio)pyrimidin-4-ol, 2-Methylthiopyrimidin-4-ol, 124700-70-5, 2-(methylthio)pyrimidin-4(3H)-one, 2-Methylthio-4-pyrimidinol, 2-Methylthio-4-pyrimidone, 2-Methylthiouracil, 2-(methylthio)-4-pyrimidinol, 2-(methylsulfanyl)pyrimidin-4-ol, 2-Methylthio-4-hydroxypyrimidine, 4(1H)-Pyrimidinone, 2-(methylthio)-, 2-(Methylthio)-4-pyrimidone, 2-Methylsulfanyl-pyrimidin-4-ol, 4-Hydroxy-2-methylthiopyrimidine, 2-(Methylthio)-4(1H)-pyrimidinone, 2-(Methylthio)-4(3H)-pyrimidinone, 2-Methylsulfanylpyrimidin-4-ol, 2-(METHYLSULFANYL)-3,4-DIHYDROPYRIMIDIN-4-ONE, 4-Pyrimidinol, 2-(methylthio)-, 2-(Methylthio)-1H-pyrimidin-4-one, 2-methylsulfanyl-1H-pyrimidin-6-one, 2-Methylsulfanyl-3H-pyrimidin-4-one, 2-Methylsulfanyl-4-oxopyrimidine, 2-Methylthio-3H-pyrimidin-4-one, UYHSQVMHSFXUOA-UHFFFAOYSA-N, 2-(Methylthio)pyrimidine-4(3H)-one, 124700-69-2, 2-methylthio-3-hydropyrimidin-4-one, EINECS 227-274-6, 2-Methylthio Uracil, NSC125339, zlchem 400, PubChem21487, S-Methyl-2-thiouracil, AC1L2Y7X, AC1Q6C0W, 2-methylthiopyrimidin-4-one, KSC941O0P, Methylthio-4-hydroxypyrimidine, SCHEMBL578880, 2-(methyl-thio)pyrimidin-4-ol, 2-methylthio-3H-pyrimid-4-one, CTK3J7770, CTK8E1707, DTXSID30206119, EBD6670, ZLC0252, 2-Methylthio-4(3H)-pyrimidinone, 2-methylthiopyrimidin-4(1H)-one, 4-hydroxy-2-methylthio-pyrimidine, CHEBI:140197, 4-Hydroxy-2-methylthio pyrimidine, 2-METHYLTHIO-4-PYRIMIDINONE, 4-Hydroxy-2-(methylthio)pyrimidine, CS-D0927, KS-000003DK, 2-(Methylsulfanyl)-4-pyrimidinol #, 2-(methylthio)pyrimidin-4(1H)-one, AC-627, ANW-32739, CM-458, MFCD00047373, MFCD00955672, NSC165518, SBB062854, ZINC17946259, 2-Methylsulfanyl-1H-pyrimidin-4-one, 2-Methylsulfanylpyrimidin-4(3H)-one, 2-methylsulphanyl-1H-pyrimidin-4-one, 4(3H)-Pyrimidinone,2-(methylthio)-, AKOS000369959, AKOS002261866, AKOS028109006, 2-(methyl-thio)pyrimidine-4(3H)-one, DS-0508, MCULE-9680690573, NSC 125339, NSC 165518, NSC-125339, NSC-165518, PB24697, RP08473, RP20749, RTR-020077, SB10357, SS-3370, 2-(Methylthio);pyrimidin-4(3H);-one, 4-Pyrimidinol,2-(methylthio)- (9CI), 2-(methylsulfanyl)pyrimidin-4 (3H)-one, AJ-70193, AK-26630, AK-43583, AN-15687, BC215669, BR-26630, CJ-15804, HC210321, SC-15482, SC-21630, SY021276, 2-methylthio-1,4-dihydro-4-oxopyrimidine, AB0012289, AB0068605, AB1011720, DB-006198, DB-062306, DB-062307, TR-020077, AM20100410, FT-0080496, FT-0635836, FT-0719851, FT-0768849, M2355, ST24027642, ST50188714, Z4020, MFCD00955672 (98%), 2-(methylsulfanyl)-1,4-dihydropyrimidin-4-one, 2-(METHYLSULFANYL)-4(3H)-PYRIMIDINONE, 4(3H)-PYRIMIDINONE, 2-(METHYLTHIO)-, A-1809, M-9100, 575M202, 751M202, AB-323/25048187, J-506489, W-105462, I14-32437, F3096-2985, 2-(Methylthio)-4(1H)-pyrimidinone; 2-(Methylthio)-1H-pyrimidin-4-one, null, S(C)c1nccc(O)n1, 2-(Methylthio)-4-pyrimidinone, C5H6N2OS, C5-H6-N2-O-S, CID79823, AR-1C9511, 2-Methylthio-4-pyrimidone, 98% 1g, ACN-028623, 4-Pyrimidinol, 2-(methylthio)- (9CI), A8200, C2139, 2-Methylthio-4-pyrimidinol, 98% - 1G 1g, 4(1H)-Pyrimidinone, 2-(methylthio)- (8CI,9CI), 76455-84-0, 1016869-97-8, 5928-87-0,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	142.02g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	142.176g/mol
Monoisotopic Mass	142.02g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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