AG00IAR0

608-34-4 | 2,4(1H,3H)-Pyrimidinedione, 3-methyl-

AG00IAR0

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CAS Number	608-34-4
Catalog Number	AG00IAR0(AGN-PC-03G515)
Chemical Name	2,4(1H,3H)-Pyrimidinedione, 3-methyl-
IUPAC Name	3-methyl-1H-pyrimidine-2,4-dione
InChI	InChI=1S/C5H6N2O2/c1-7-4(8)2-3-6-5(7)9/h2-3H,1H3,(H,6,9)
InChI Key	VPLZGVOSFFCKFC-UHFFFAOYSA-N
MDL Number	MFCD00038014
Molecular Formula	C5H6N2O2
Molecular Weight	126.1133
NSC Number	45626
SMILES	O=C1N(C)C(C=CN1)=O
Synonyms	3-methyluracil, 3-Methyluracil, 608-34-4, 3-methylpyrimidine-2,4(1H,3H)-dione, 2,4(1H,3H)-Pyrimidinedione, 3-methyl-, Uracil, methyl-, 3-methyl-1H-pyrimidine-2,4-dione, 3-MeU, Methyl-2,4(1H,3H)-pyrimidinedione, MFCD00038014, 2,4(1H,3H)-Pyrimidinedione, methyl-, 3-methyl-2,4(1H,3H)-pyrimidinedione, 3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione, 3-methyl-1,3-dihydropyrimidine-2,4-dione, [3H]-Methyluracil, NSC 45626, AC1L2WKY, AC1Q6CT9, SCHEMBL40761, SCHEMBL13242249, CHEBI:74732, CTK1I0040, CTK5B2314, 2,4-Dihydroxy-3-methylpyrimidine, VPLZGVOSFFCKFC-UHFFFAOYSA-N, NSC45626, ZINC8765763, 2,3H)-Pyrimidinedione, 3-methyl-, NSC-45626, SBB004255, AKOS002304012, AKOS003348643, MCULE-5392412214, 2-hydroxy-3-methylpyrimidin-4(3H)-one, 2,4(1H,3H)-Pyrimidinedione,3-methyl-, 3-methylpyrimidine-2,4(1H, 3H)-dione, AJ-59255, AS-47233, 2(1H)-Pyrimidinone, 6-hydroxy-1-methyl-, LS-158699, FT-0692244, ST45025089, 2-hydroxy-3-methyl-4-oxo-3,4-dihydropyrimidine, 2,4(1H,3H)-Pyrimidinedione, 3-methyl- (9CI), AC-907/25014072, W-203272, Z2588063529, InChI=1/C5H6N2O2/c1-7-4(8)2-3-6-5(7)9/h2-3H,1H3,(H,6,9, 66449-41-0, Methyluracil, C5-H6-N2-O2, CID79066, AR-1F4581, 27942-00-3, 62618-08-0,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.043g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	126.115g/mol
Monoisotopic Mass	126.043g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

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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