chempirical

3-Bromo-2(1H)-pyridinone

C5H4BrNOCAS 13466-43-8174.00 g/mol

Open in Covalent MOL file
HONBr
Aryl halidePhenol

Properties

Molecular formula
C5H4BrNO
Molar mass
174.00 g/mol
Exact mass
172.9476 Da
logP
1.55Crippen estimate
Polar surface area
33.1 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
13466-43-8
SMILES
Oc1ncccc1Br
InChIKey
YDUGVOUXNSWQSW-UHFFFAOYSA-N
InChI
InChI=1S/C5H4BrNO/c6-4-2-1-3-7-5(4)8/h1-3H,(H,7,8)

Weigh it out

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

Names and synonyms

10 names
  • 2(1H)-Pyridinone, 3-bromo-
  • 2(1H)-Pyridone, 3-bromo-
  • 3-Bromo-2(1H)-pyridone
  • 3-Bromo-2-pyridone
  • 3-Bromo-2-hydroxypyridine
  • 3-Bromo-2-pyridinone
  • 3-Bromopyridin-2-ol
  • 3-Bromo-2-oxo-1,2-dihydropyridine
  • 3-Bromo-1,2-dihydropyridin-2-one
  • 3-Bromo-1H-pyridin-2-one

Work with 3-Bromo-2(1H)-pyridinone

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

2,3-Dihydroxypyridine16867-04-256 % similar 2,3-Pyridinediol84719-32-456 % similar 5-Bromo-1(2H)-isoquinolinone190777-77-655 % similar 5-Bromo-1,7-naphthyridin-8(7H)-one67967-14-055 % similar 2-Hydroxy-3-methylpyridine1003-56-152 % similar 3-Amino-2(1H)-pyridinone33630-99-852 % similar 3-Bromo-2-methoxypyridine13472-59-848 % similar 2-Amino-3-bromopyridine13534-99-148 % similar

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

Same formula

5-Bromo-2-hydroxypyridine13466-38-1 4-Bromopyridine N-oxide14248-50-1 3-Bromopyridine oxide2402-97-3 6-Bromo-2(1H)-pyridinone27992-32-1 3-Bromo-4-pyridinol36953-41-0 2-Bromo-3-pyridinol6602-32-0 5-Bromo-3-pyridinol74115-13-2

Elsewhere

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