5-Hydroxy-2,4(1H,3H)-pyrimidinedione

C₄H₄N₂O₃CAS 20636-41-3128.09 g/mol

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Properties

Molecular formula: C₄H₄N₂O₃
Molar mass: 128.09 g/mol
Exact mass: 128.0222 Da
Melting point: 310 °C (decomposes)
logP: -0.41Crippen estimate
Polar surface area: 86.5 Å²
H-bond donors / acceptors: 3 / 5
Rotatable bonds: 0

Identifiers

CAS number

20636-41-3

SMILES

Oc1ncc(O)c(O)n1

InChIKey

OFJNVANOCZHTMW-UHFFFAOYSA-N

InChI

InChI=1S/C4H4N2O3/c7-2-1-5-4(9)6-3(2)8/h1,7H,(H2,5,6,8,9)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

2,4(1H,3H)-Pyrimidinedione, 5-hydroxy-
NSC 90431
2,4,5-Trihydroxypyrimidine

Work with 5-Hydroxy-2,4(1H,3H)-pyrimidinedione

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

5-Chlorouracil1820-81-156 % similar 5-Bromouracil51-20-756 % similar 5-Fluorouracil51-21-856 % similar Thymine65-71-456 % similar 5-Iodouracil696-07-156 % similar 5-Aminouracil932-52-556 % similar 5-(Hydroxymethyl)uracil4433-40-352 % similar 5-Formyluracil1195-08-050 % similar

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

Same formula

5-Hydroxyuracil496-76-4 Barbituric acid67-52-7

Elsewhere

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