AG003QB2

4786-52-1 | Ethyl 4-hydroxypyrimidine-5-carboxylate

AG003QB2

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CAS Number	4786-52-1
Catalog Number	AG003QB2(AGN-PC-0OAQHU)
Chemical Name	Ethyl 4-hydroxypyrimidine-5-carboxylate
IUPAC Name	ethyl 6-oxo-1H-pyrimidine-5-carboxylate
InChI	InChI=1S/C7H8N2O3/c1-2-12-7(11)5-3-8-4-9-6(5)10/h3-4H,2H2,1H3,(H,8,9,10)
InChI Key	PLMIZYMXBHSARX-UHFFFAOYSA-N
MDL Number	MFCD00235034
Molecular Formula	C7H8N2O3
Molecular Weight	168.1500
NSC Number	69216
SMILES	C(=O)(OCC)c1c(=O)[nH]cnc1
Synonyms	ethyl 4-hydroxypyrimidine-5-carboxylate, 4786-52-1, ethyl 6-oxo-1,6-dihydropyrimidine-5-carboxylate, 4-Hydroxy-pyrimidine-5-carboxylic acid ethyl ester, 71133-20-5, 5-Pyrimidinecarboxylic acid, 4-hydroxy-, ethyl ester, Ethyl 4-hydroxy-5-pyrimidinecarboxylate, 6-Oxo-1,6-dihydro-pyrimidine-5-carboxylic acid ethyl ester, 5-Pyrimidinecarboxylic acid, 1,4-dihydro-4-oxo-, ethyl ester, NSC 69216, MLS002693643, WLN: T6N CNJ DQ EVO2, PLMIZYMXBHSARX-UHFFFAOYSA-N, 4-Hydroxypyrimidine-5-carboxylic acid ethyl ester, Ethyl 6-oxo-1,6-dihydro-pyrimidine-5-carboxylate, ethyl 6-oxo-1H-pyrimidine-5-carboxylate, NSC69216, PubChem21506, ACMC-209kar, AC1Q34BU, AC1Q63MF, NCIOpen2_000533, SCHEMBL798009, AC1L3W98, CTK4J0392, KS-00000BJI, DTXSID00197308, HMS3085B03, ALBB-017345, ANW-30577, ANW-50503, BBL004272, MFCD00194922, MFCD00235034, NSC-69216, STL124095, STL298566, ZINC17003049, AKOS005167108, AKOS015830884, AKOS028108954, Ethyl4-Hydroxypyrimidine-5-carboxylate, Pyrimidine, 4-hydroxy-5-carboethoxy-, AB05293, AC-9286, ACN-001123, AN-7161, CS-W000639, DS-0307, GS-5818, HP21355, MCULE-6774569622, RL03786, TRA0053906, Ethyl 4-hydroxy-pyrimidine-5-carboxylate, ethyl 4-hydroxypyrimidine 5-car-boxylate, ethyl 4-oxo-3H-pyrimidine-5-carboxylate, AJ-69864, AK-24103, BC205004, BR-24103, CJ-15717, ethyl pyrimidin-6(1h)-one-5-carboxylate, HC210403, QC-10070, SC-45581, SMR001559588, SY012807, AB0025058, AB0071059, LS-134862, ST2413006, TR-017572, 4CH-001514, AK00739570, AM20100193, BB 0242273, FT-0648591, W6450, 4-Hydroxypyrimidine-5-carboxylicacidethylester, H57381, S-3638, Z-5822, Ethyl 1,4-dihydro-4-oxo-5-pyrimidinecarboxylate, ethyl 3,4-dihydro-4-oxopyrimidine-5-carboxylate, ethyl 6-oxo-1,6-dihydro-5-pyrimidinecarboxylate, MFCD00235034 (97+%), 786O521, I03-0504, J-515532, F1967-1633, Z1436472914, 5-Pyrimidinecarboxylicacid, 1,6-dihydro-6-oxo-, ethyl ester, 6-Oxo-1,6-dihydro-pyrimidine-5-carboxylic acid ethyl ester, 5-Pyrimidinecarboxylic acid, 1,4-dihydro-4-oxo-, ethyl ester (9CI), C7H8N2O3, C7-H8-N2-O3, CID96347, AR-1I9254, 5-Pyrimidinecarboxylic acid, ethyl ester, C2325, M0190, 4-Hydroxy-pyrimidine-5-carboxylicacidethylester, 5-Pyrimidinecarboxylic acid,4-dihydro-4-oxo-, ethyl ester, 5063-65-0, 868387-45-5,

Complexity	268
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	168.152g/mol
Monoisotopic Mass	168.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	67.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number