chempirical

2-Pyridinol

C5H5NOCAS 72762-00-695.10 g/mol

Open in Covalent MOL file
HON
Phenol

Properties

Molecular formula
C5H5NO
Molar mass
95.10 g/mol
Exact mass
95.0371 Da
Melting point
107.8 °C
logP
0.79Crippen estimate
Polar surface area
33.1 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
72762-00-6
SMILES
Oc1ccccn1
InChIKey
UBQKCCHYAOITMY-UHFFFAOYSA-N
InChI
InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)

Weigh it out

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

Work with 2-Pyridinol

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

2-Fluoropyridine372-48-548 % similar 2,2′-Bipyridine366-18-748 % similar 2,6-Dihydroxypyridine626-06-248 % similar 4-Hydroxypyrimidine4562-27-046 % similar 3(2H)-Pyridazinone504-30-346 % similar 4(3H)-Pyrimidinone51953-17-446 % similar 4-Hydroxy-2(1H)-pyridinone626-03-944 % similar 2,6-Dihydroxypyridine hydrochloride10357-84-343 % similar

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

Same formula

Pyrrole-2-carboxaldehyde1003-29-8 4-Pyridone108-96-3 3-Hydroxypyridine109-00-2 2-Pyridone142-08-5 4-Hydroxypyridine626-64-2 Pyridine-N-oxide694-59-7 Pyrrole-3-carboxaldehyde7126-39-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook