Ethyl 1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinecarboxylate

C₇H₈N₂O₄CAS 28485-17-8184.15 g/mol

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Properties

Molecular formula: C₇H₈N₂O₄
Molar mass: 184.15 g/mol
Exact mass: 184.0484 Da
Melting point: 236–237 °C
logP: 0.06Crippen estimate
Polar surface area: 92.5 Å²
H-bond donors / acceptors: 2 / 6
Rotatable bonds: 2

Identifiers

CAS number

28485-17-8

SMILES

CCOC(=O)c1cnc(O)nc1O

InChIKey

MKNYHTGOVKPZMU-UHFFFAOYSA-N

InChI

InChI=1S/C7H8N2O4/c1-2-13-6(11)4-3-8-7(12)9-5(4)10/h3H,2H2,1H3,(H2,8,9,10,12)

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Names and synonyms

7 names

5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo-, ethyl ester
Uracil-5-carboxylic acid ethyl ester
5-Carbethoxyuracil
5-Ethoxycarbonyluracil
NSC 513173
Ethyl 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2,4-Dihydroxypyrimidine-5-carboxylic acid ethyl ester

Work with Ethyl 1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinecarboxylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl 1,2,3,4-tetrahydro-4-oxo-2-thioxo-5-pyrimidinecarboxylate38026-46-971 % similar Ethyl 1,6-dihydro-2-(methylthio)-6-oxo-5-pyrimidinecarboxylate53554-29-367 % similar 5-Acetyl-2,4(1H,3H)-pyrimidinedione6214-65-955 % similar Ethyl 2-amino-1,4-dihydro-4-oxo-5-pyrimidinecarboxylate15400-53-054 % similar 1,2,3,4-Tetrahydro-2,4-dioxo-5-pyrimidinecarboxylic acid23945-44-053 % similar Ethyl 2,4-dichloro-5-pyrimidinecarboxylate51940-64-852 % similar Diethyl 2,5-dihydroxyterephthalate5870-38-250 % similar Ethyl 4-chloro-2-(methylthio)-5-pyrimidinecarboxylate5909-24-047 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4,5-Dimethyl 1H-imidazole-4,5-dicarboxylate3304-70-9

Elsewhere

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