2-Bromo-3-methoxypyridine

C₆H₆BrNOCAS 24100-18-3188.02 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₆H₆BrNO
Molar mass: 188.02 g/mol
Exact mass: 186.9633 Da
Melting point: 40–43 °C
logP: 1.85Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

24100-18-3

SMILES

COc1cccnc1Br

InChIKey

PDOWLYNSFYZIQX-UHFFFAOYSA-N

InChI

InChI=1S/C6H6BrNO/c1-9-5-3-2-4-8-6(5)7/h2-4H,1H3

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

Names and synonyms

1 names

Pyridine, 2-bromo-3-methoxy-

Work with 2-Bromo-3-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

3-Methoxy-2(1H)-pyridinone20928-63-655 % similar 2-Chloro-3-methoxypyridine52605-96-655 % similar 8-Methoxyquinoline938-33-053 % similar 2-Bromo-3-methylpyridine3430-17-950 % similar 6-Bromo-8-methoxyquinoline103028-32-649 % similar 2-Bromo-1,3-dimethoxybenzene16932-45-948 % similar 2-Bromoanisole578-57-448 % similar 1,2-Dimethoxybenzene91-16-746 % 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-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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