AG004NWW

869891-41-8 | Methyl 2,4-dihydroxy-6-methylpyrimidine-5-carboxylate

AG004NWW

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CAS Number	869891-41-8
Catalog Number	AG004NWW(AGN-PC-0WADQE)
Chemical Name	Methyl 2,4-dihydroxy-6-methylpyrimidine-5-carboxylate
IUPAC Name	methyl 6-methyl-2,4-dioxo-1H-pyrimidine-5-carboxylate
InChI	InChI=1S/C7H8N2O4/c1-3-4(6(11)13-2)5(10)9-7(12)8-3/h1-2H3,(H2,8,9,10,12)
InChI Key	WMENLTSMANJRGJ-UHFFFAOYSA-N
MDL Number	MFCD20133912
Molecular Formula	C7H8N2O4
Molecular Weight	184.1494
SMILES	COC(=O)C1=C(O)N=C(O)N=C1C
Synonyms	Methyl 2,4-dihydroxy-6-methylpyrimidine-5-carboxylate, 869891-41-8, methyl 6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, SCHEMBL62885, CTK6I8497, CTK8B7197, DTXSID50651687, WMENLTSMANJRGJ-UHFFFAOYSA-N, AC1Q4239, 3703AC, ANW-56690, MFCD20133912, ZINC20280890, AKOS008101439, AKOS016001811, MCULE-4281163855, AJ-76830, AK-67951, TC-145435, 4CH-000986, ST24047574, EN300-29408, Z317046530, 4-methyl-2,6-dioxo-3H-pyrimidine-5-carboxylic acid methyl ester, C7H8N2O4, Methyl2,4-dihydroxy-6-methylpyrimidine-5-carboxylate,

Complexity	319
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.048g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	184.151g/mol
Monoisotopic Mass	184.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	84.5A^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-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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