chempirical

3-Bromo-2-hydroxy-5-methylpyridine

C6H6BrNOCAS 17282-02-9188.02 g/mol

Open in Covalent MOL file
NHOBr
Aryl halide

Properties

Molecular formula
C6H6BrNO
Molar mass
188.02 g/mol
Exact mass
186.9633 Da
logP
1.45Crippen estimate
Polar surface area
32.9 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

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

Identifiers

CAS number
17282-02-9
SMILES
CC1=CNC(=O)C(=C1)Br
InChIKey
KHBRMXVUQOVORD-UHFFFAOYSA-N
InChI
InChI=1S/C6H6BrNO/c1-4-2-5(7)6(9)8-3-4/h2-3H,1H3,(H,8,9)

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Work with 3-Bromo-2-hydroxy-5-methylpyridine

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-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine76041-73-150 % similar Methyl 5-bromo-6-hydroxynicotinate381247-99-047 % similar 5-Bromo-6-hydroxynicotinic acid41668-13-747 % similar 2-Hydroxy-5-methyl-3-nitropyridine7464-14-447 % similar 2,4-Dimethylpyrrole625-82-141 % similar 5-Bromo-2-hydroxy-4-methylpyridine164513-38-641 % similar 4-Bromopyridazine-3,6-diol15456-86-741 % similar 5-Bromo-2-hydroxy-3-nitro-4-picoline228410-90-040 % 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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