chempirical

5-Fluoro-6-methoxypyridine-3-boronic acid

C6H7BFNO3CAS 856250-60-7170.93 g/mol

Open in Covalent MOL file
BNOFHOHO
Aryl halideBoronic acidEther

Properties

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

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
856250-60-7
SMILES
B(C1=CC(=C(N=C1)OC)F)(O)O
InChIKey
OCWTXKZPAZAQQW-UHFFFAOYSA-N
InChI
InChI=1S/C6H7BFNO3/c1-12-6-5(8)2-4(3-9-6)7(10)11/h2-3,10-11H,1H3

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Names and synonyms

1 names
  • (5-Fluoro-6-methoxypyridin-3-yl)boronic acid

Work with 5-Fluoro-6-methoxypyridine-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

(3,5-Difluoro-4-methoxyphenyl)boronic acid208641-98-957 % similar 2-Methoxy-3-fluoro-5-bromopyridine124432-70-854 % similar 5-Fluoro-6-methoxy-pyridin-3-ylamine886372-63-054 % similar 3-Fluoro-4-methoxybenzeneboronic acid149507-26-653 % similar 2-Methoxypyrimidine-5-boronic acid628692-15-951 % similar 4-Fluoro-3-methoxyphenylboronic acid854778-31-749 % similar (6-Methoxypyridin-3-yl)boronic acid163105-89-347 % similar 5-Methoxypyridine-3-boronic acid850991-69-447 % similar

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

Same formula

5-Fluoro-2-methoxypyridine-4-boronic acid1043869-98-2

Elsewhere

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