3-Fluoro-4-biphenylboronic acid

C₁₂H₁₀BFO₂CAS 409108-13-0216.02 g/mol

Open in Covalent MOL file

Aryl halide Boronic acid

Properties

Molecular formula: C₁₂H₁₀BFO₂
Molar mass: 216.02 g/mol
Exact mass: 216.0758 Da
logP: 1.17Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
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

409108-13-0

SMILES

B(C1=C(C=C(C=C1)C2=CC=CC=C2)F)(O)O

InChIKey

JUHFAPMMWMSLKH-UHFFFAOYSA-N

InChI

InChI=1S/C12H10BFO2/c14-12-8-10(6-7-11(12)13(15)16)9-4-2-1-3-5-9/h1-8,15-16H

Weigh it out

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Work with 3-Fluoro-4-biphenylboronic 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

B-(3-Fluoro-4′-propyl[1,1′-biphenyl]-4-yl)boronic acid909709-42-862 % similar 2-Fluorophenylboronic acid1993-03-957 % similar 2,4-Difluorophenylboronic acid144025-03-656 % similar (4-Chloro-2-fluorophenyl)boronic acid160591-91-353 % similar 2-Fluoro-4-methylphenylboronic acid170981-26-753 % similar 4-Bromo-2-fluorobenzeneboronic acid216393-64-553 % similar B-(2-Fluoro-4-iodophenyl)boronic acid374790-98-453 % similar 4-Benzyloxy-2-fluorophenylboronic acid166744-78-153 % similar

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

Same formula

4-(4-Fluorophenyl)phenylboronic acid140369-67-1 2-Fluoro-4-biphenylboronic Acid178305-99-2

Elsewhere

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