2-Fluoropyridine-3-boronic acid

C5H5BFNO2CAS 174669-73-9140.91 g/mol

Open in Covalent MOL file
BNFHOHO
Aryl halideBoronic 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 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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-Methylpyridine-3-boronic acid899436-71-655 % similar 8-Quinolineboronic acid86-58-853 % 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

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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