AG002BQA

19875-04-8 | 4(3H)-Pyrimidinone, 2-methyl-

AG002BQA

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CAS Number	19875-04-8
Catalog Number	AG002BQA(AGN-PC-0JNPMP)
Chemical Name	4(3H)-Pyrimidinone, 2-methyl-
IUPAC Name	2-methyl-1H-pyrimidin-6-one
InChI	InChI=1S/C5H6N2O/c1-4-6-3-2-5(8)7-4/h2-3H,1H3,(H,6,7,8)
InChI Key	QWIDYOLZFAQBOB-UHFFFAOYSA-N
MDL Number	MFCD05864425
Molecular Formula	C5H6N2O
Molecular Weight	110.1139
NSC Number	69938
SMILES	O=c1[nH]c(C)ncc1
Synonyms	2-Methylpyrimidin-4-ol, 4-Hydroxy-2-methylpyrimidine, 19875-04-8, 67383-35-1, 2-methylpyrimidin-4(3H)-one, 2-Methyl-4(3H)-pyrimidinone, 2-methyl-4-pyrimidinol, 4(1H)-Pyrimidinone, 2-methyl-, 2-methyl-1H-pyrimidin-6-one, 4(3H)-Pyrimidinone,2-methyl-, 4(1H)-Pyrimidinone, 2-methyl- (8CI,9CI), QWIDYOLZFAQBOB-UHFFFAOYSA-N, EC-000.2012, NSC69938, 2-Methylpyrimidin-4-one, 2-Methyl-pyrimidin-4-ol, 4-Pyrimidinol,2-methyl-, AC1L5HP6, AC1Q6C0T, methylpyrimidin-4(3H)-one, SCHEMBL755723, 2-Methylpyrimidine-4(3H)-one, CTK5C6108, CTK8H4767, 2-Methyl-4(1H)-pyrimidinone #, KS-00000JM4, KS-00000NQ6, ANW-51099, MFCD00234103, MFCD05864425, NSC-69938, ZINC18038081, 2-methyl-1,4-dihydropyrimidin-4-one, 2-methyl-3,4-dihydropyrimidin-4-one, AKOS009845214, AKOS015856515, AKOS015901383, CM-1214, DS-3240, MCULE-5044952802, RP18961, RP18962, VZ25001, AJ-70239, AK-21836, AK-46845, BR-21836, CJ-15811, SC-52114, SC-94927, AB0026181, AB1010399, DB-010252, TR-032270, 4CH-001539, AM20100623, FT-0649613, FT-0650116, ST24022353, ST24040917, W7788, EN300-67587, A22342, 875M048, A835731, J-513387, J-515479, I14-15090, Z1269638492, InChI=1/C5H6N2O/c1-4-6-3-2-5(8)7-4/h2-3H,1H3,(H,6,7,8, 2-Methyl-4-hydroxypyrimidine;2-Methyl-4-hydroxy-pyrimidine;4-Hydroxy-2-methyl-pyrimidin, C5H6N2O, 4(3H)-pyrimidinone, 2-methyl-, AR-1E4193, CID250451, 2-Methylpyrimidin-4-ol, 97% - 1G 1g, 4-Pyrimidinol, 2-methyl- (6CI,7CI,9CI), S-2986, 78019-77-9,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	110.048g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	110.116g/mol
Monoisotopic Mass	110.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

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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