4-Bromopyridin-3-ol

C₅H₄BrNOCAS 161417-28-3174.00 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₅H₄BrNO
Molar mass: 174.00 g/mol
Exact mass: 172.9476 Da
logP: 1.55Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

161417-28-3

SMILES

C1=CN=CC(=C1Br)O

InChIKey

YCVSFCXUHPVAFH-UHFFFAOYSA-N

InChI

InChI=1S/C5H4BrNO/c6-4-1-2-7-3-5(4)8/h1-3,8H

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Names and synonyms

1 names

4-Bromo-3-hydroxypyridine

Work with 4-Bromopyridin-3-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

4-Bromo-3-methylpyridine10168-00-050 % similar 3-Hydroxy-4-methylpyridine1121-19-350 % similar 4-Bromo-3-fluoropyridine hydrochloride1159811-44-545 % similar 4-Bromo-3-pyridinecarbonitrile154237-70-445 % similar 3-Hydroxyisonicotinaldehyde1849-54-345 % similar 3-Bromo-4-fluoropyridine116922-60-245 % similar 3-Bromo-4-methylpyridine3430-22-645 % similar 3-Bromoisonicotinic acid13959-02-941 % similar

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

Same formula

5-Bromo-2-hydroxypyridine13466-38-1 3-Bromo-2(1H)-pyridinone13466-43-8 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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