(2-Bromopyridin-4-yl)methanol

C₆H₆BrNOCAS 118289-16-0188.02 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₆H₆BrNO
Molar mass: 188.02 g/mol
Exact mass: 186.9633 Da
logP: 1.34Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

118289-16-0

SMILES

C1=CN=C(C=C1CO)Br

InChIKey

IQNUGAFIKDRYRP-UHFFFAOYSA-N

InChI

InChI=1S/C6H6BrNO/c7-6-3-5(4-9)1-2-8-6/h1-3,9H,4H2

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Names and synonyms

1 names

2-Bromopyridine-4-methanol

Work with (2-Bromopyridin-4-yl)methanol

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

4,4'-Bis(hydroxymethyl)-2,2'-bipyridine109073-77-061 % similar (2-Chloropyridin-4-yl)methanol100704-10-755 % similar (2-Aminopyridin-4-yl)methanol105250-17-755 % similar 2-Bromo-4-(1-piperidinylmethyl)pyridine88046-02-051 % similar 4-Pyridinemethanol,2-methoxy-(9ci)123148-66-350 % similar 4-Pyridinemethanol586-95-846 % similar 2-Bromo-4-cyanopyridine10386-27-345 % similar 2-Bromo-4-iodopyridine100523-96-445 % similar

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

Same formula

3-Amino-4-bromophenol100367-37-1 4-Bromo-2-methoxypyridine100367-39-3 2-Bromo-5-methoxypyridine105170-27-2 2-Amino-3-bromophenol116435-77-9 (6-Bromo-pyridin-3-yl)-methanol122306-01-8 4-Bromo-2-pyridinemethanol131747-45-0 3-Bromo-2-methoxypyridine13472-59-8 5-Bromo-2-methoxypyridine13472-85-0

Elsewhere

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