2-Fluoropyridine-3-boronic acid

C₅H₅BFNO₂CAS 174669-73-9140.91 g/mol

Open in Covalent MOL file

Aryl halide Boronic acid

Properties

Molecular formula: C₅H₅BFNO₂
Molar mass: 140.91 g/mol
Exact mass: 141.0397 Da
logP: -1.10Crippen estimate
Polar surface area: 53.4 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

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

174669-73-9

SMILES

B(C1=C(N=CC=C1)F)(O)O

InChIKey

YUHZIUAREWNXJT-UHFFFAOYSA-N

InChI

InChI=1S/C5H5BFNO2/c7-5-4(6(9)10)2-1-3-8-5/h1-3,9-10H

Weigh it out

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

Names and synonyms

1 names

2-Fluoro-3-pyridylboronic acid

Work with 2-Fluoropyridine-3-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-Chloropyridin-3-yl)boronic acid381248-04-055 % similar 2-Bromopyridin-3-ylboronic acid452972-08-655 % similar 2,6-Difluoropyridine-3-boronic acid136466-94-952 % similar Quinolin-5-ylboronic acid355386-94-652 % similar (2-Methoxypyridin-3-yl)boronic acid163105-90-650 % similar 2-Fluoro-3-pyridinol174669-74-050 % similar 2-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine452972-14-450 % similar 2,3-Difluoropyridine1513-66-248 % similar

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

Same formula

(6-Fluoropyridin-3-yl)boronic acid351019-18-6 2-Fluoropyridine-4-boronic acid401815-98-3 (3-Fluoropyridin-4-yl)boronic acid458532-97-3 (5-Fluoropyridin-3-yl)boronic acid872041-86-6

Elsewhere

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