(4-Bromopyridin-3-yl)methanol

C₆H₆BrNOCAS 197007-87-7188.02 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

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number

197007-87-7

SMILES

C1=CN=CC(=C1Br)CO

InChIKey

DDZMBVCLSZAYOT-UHFFFAOYSA-N

InChI

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

Weigh it out

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Work with (4-Bromopyridin-3-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

(3-Bromopyridin-4-yl)methanol146679-66-571 % similar 4-Aminopyridine-3-methanol138116-34-455 % similar 2-Bromobenzyl alcohol18982-54-254 % similar 3,4-Dibromopyridine13534-90-252 % similar 4-Bromopyridin-3-ol161417-28-350 % similar 3-Fluoro-4-(hydroxymethyl)pyridine870063-60-850 % similar 4-Bromo-3-methylpyridine10168-00-045 % similar 3-Amino-4-bromopyridine239137-39-445 % 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 (2-Bromopyridin-4-yl)methanol118289-16-0 (6-Bromo-pyridin-3-yl)-methanol122306-01-8 4-Bromo-2-pyridinemethanol131747-45-0 3-Bromo-2-methoxypyridine13472-59-8

Elsewhere

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