Pyrimidin-5-ol

C4H4N2OCAS 26456-59-796.09 g/mol

Open in Covalent MOL file
NNOH
Phenol

Properties

Molecular formula
C4H4N2O
Molar mass
96.09 g/mol
Exact mass
96.0324 Da
logP
0.18Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
26456-59-7
SMILES
C1=C(C=NC=N1)O
InChIKey
LTXJLQINBYSQFU-UHFFFAOYSA-N
InChI
InChI=1S/C4H4N2O/c7-4-1-5-3-6-2-4/h1-3,7H

Weigh it out

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

Names and synonyms

1 names
  • 5-Hydroxypyrimidine

Work with Pyrimidin-5-ol

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

3-Hydroxypyridine109-00-245 % similar 2-Chloro-5-hydroxypyrimidine4983-28-243 % similar 3-Fluoro-5-hydroxypyridine209328-55-242 % similar 5-Aminopyridin-3-ol3543-01-942 % similar 3-Hydroxy-5-methylpyridine42732-49-042 % similar 5-Chloro-3-pyridinol74115-12-142 % similar 5-Bromo-3-pyridinol74115-13-242 % similar (Pyrimidin-5-yl)boronic acid109299-78-741 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Imidazole-2-carboxaldehyde10111-08-7 Imidazole-4-carboxaldehyde3034-50-2 1H-Pyrazole-4-carbaldehyde35344-95-7 1H-Pyrazole-3-carbaldehyde3920-50-1 4-Hydroxypyrimidine4562-27-0 3(2H)-Pyridazinone504-30-3 4(3H)-Pyrimidinone51953-17-4 4-Pyrimidinol51953-18-5

Elsewhere

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