5-Fluoro-2-methoxypyridine-4-boronic acid

C₆H₇BFNO₃CAS 1043869-98-2170.93 g/mol

Open in Covalent MOL file

Aryl halide Boronic acid Ether

Properties

Molecular formula: C₆H₇BFNO₃
Molar mass: 170.93 g/mol
Exact mass: 171.0503 Da
logP: -1.09Crippen estimate
Polar surface area: 62.6 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 2

Identifiers

CAS number

1043869-98-2

SMILES

B(C1=CC(=NC=C1F)OC)(O)O

InChIKey

VGPMZARHJYGFSE-UHFFFAOYSA-N

InChI

InChI=1S/C6H7BFNO3/c1-12-6-2-4(7(10)11)5(8)3-9-6/h2-3,10-11H,1H3

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Names and synonyms

1 names

(5-Fluoro-2-methoxypyridin-4-yl)boronic acid

Work with 5-Fluoro-2-methoxypyridine-4-boronic acid

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-Fluoro-5-methoxyphenylboronic acid406482-19-753 % similar (2,4,5-Trifluorophenyl)boronic acid247564-72-344 % similar (3-Fluoropyridin-4-yl)boronic acid458532-97-342 % similar 5-Fluoro-2-methoxyphenylboronic acid179897-94-041 % similar 4-Fluoro-3-methoxyphenylboronic acid854778-31-741 % similar 5-Fluoro-2-methoxy-4(3H)-pyrimidinone1480-96-239 % similar 2-Fluoro-3-methoxyphenylboronic acid352303-67-438 % similar (5-Bromo-2-fluorophenyl)boronic acid112204-57-638 % similar

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

Elsewhere

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