AG000MNQ

124703-78-2 | 4(3H)-Pyrimidinone, 6-ethyl-

AG000MNQ

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CAS Number	124703-78-2
Catalog Number	AG000MNQ(AGN-PC-0NGHTW)
Chemical Name	4(3H)-Pyrimidinone, 6-ethyl-
IUPAC Name	4-ethyl-1H-pyrimidin-6-one
InChI	InChI=1S/C6H8N2O/c1-2-5-3-6(9)8-4-7-5/h3-4H,2H2,1H3,(H,7,8,9)
InChI Key	SWJOGZCZSPXIJG-UHFFFAOYSA-N
MDL Number	MFCD09909797
Molecular Formula	C6H8N2O
Molecular Weight	124.1405
SMILES	O=C1NC=NC(CC)=C1
Synonyms	124703-78-2, 6-Ethylpyrimidin-4-ol, 6-ethylpyrimidin-4(3H)-one, 6-ethylpyrimidin-4(1H)-one, 6-ethyl-1H-pyrimidin-4-one, 6-ETHYL-4-PYRIMIDINOL, 4(1H)-Pyrimidinone, 6-ethyl-, 4(3H)-Pyrimidinone, 6-ethyl-, 4-HYDROXY-6-ETHYLPYRIMIDINE, F1967-0477, PubChem23619, ACMC-20mr5s, 4-Ethyl-6-hydroxypyrimidine, 4-hydroxy-6-ethyl pyrimidine, SCHEMBL503382, 6-Ethyl-3H-pyrimidin-4-one, CTK0F7104, DTXSID90456451, SWJOGZCZSPXIJG-UHFFFAOYSA-N, 6-ETHYL-4-HYDROXYPYRIMIDINE, ZINC2559586, ANW-56849, MFCD09909797, AKOS005207211, AKOS010485506, AB54953, ACN-000923, AM91232, DS-3456, MCULE-7698961997, QC-4480, AJ-40293, AK100022, AN-16606, DB-010265, TC-145594, CS-0018881, FT-0739861, ST24024380, EN300-53291, Y-5974, J-518691, Z1258578316, RD-0185, CID11137162, 4(1H)-Pyrimidinone, 6-ethyl- (9CI),

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	124.064g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	124.143g/mol
Monoisotopic Mass	124.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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