chempirical

5-Hydroxyuracil

C4H4N2O3CAS 496-76-4128.09 g/mol

Open in Covalent MOL file
ONHONHO
Ketone

Properties

Molecular formula
C4H4N2O3
Molar mass
128.09 g/mol
Exact mass
128.0222 Da
logP
-0.56Crippen estimate
Polar surface area
82.3 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
0

Identifiers

CAS number
496-76-4
SMILES
O=C1CN=C(O)N=C1O
InChIKey
FQXOOGHQVPKHPG-UHFFFAOYSA-N
InChI
InChI=1S/C4H4N2O3/c7-2-1-5-4(9)6-3(2)8/h1H2,(H2,5,6,8,9)

Weigh it out

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

Names and synonyms

5 names
  • 2,4,5(3H)-Pyrimidinetrione, dihydro-
  • Isobarbituric acid
  • Dihydro-2,4,5(3H)-pyrimidinetrione
  • NSC 95958
  • 1,3-Diazinane-2,4,5-trione

Work with 5-Hydroxyuracil

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

Hydantoin461-72-350 % similar Dihydrouracil504-07-432 % similar

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

Same formula

5-Hydroxy-2,4(1H,3H)-pyrimidinedione20636-41-3 Barbituric acid67-52-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia