chempirical

2-Bromo-5-methoxypyridine

C6H6BrNOCAS 105170-27-2188.02 g/mol

Open in Covalent MOL file
ONBr
Aryl halideEther

Properties

Molecular formula
C6H6BrNO
Molar mass
188.02 g/mol
Exact mass
186.9633 Da
logP
1.85Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
105170-27-2
SMILES
COC1=CN=C(C=C1)Br
InChIKey
WULVUFYZVYHTFX-UHFFFAOYSA-N
InChI
InChI=1S/C6H6BrNO/c1-9-5-2-3-6(7)8-4-5/h2-4H,1H3

Weigh it out

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

Work with 2-Bromo-5-methoxypyridine

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-Bromo-5-methoxypyrimidine1209459-99-354 % similar 2-Amino-5-methoxypyridine10167-97-253 % similar (5-Methoxypyridin-2-yl)methanol127978-70-548 % similar 5-Methoxy-2-(trifluoromethyl)pyridine216766-13-148 % similar 2-Bromo-5-methylpyridine3510-66-548 % similar 4-Bromoanisole104-92-746 % similar 2,5-Dibromopyridine624-28-246 % similar 1,4-Dimethoxybenzene150-78-746 % 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-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 5-Bromo-2-methoxypyridine13472-85-0

Elsewhere

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