3-Fluoro-4-methoxybenzeneboronic acid

C₇H₈BFO₃CAS 149507-26-6169.95 g/mol

Open in Covalent MOL file

Aryl halide Boronic acid Ether

Properties

Molecular formula: C₇H₈BFO₃
Molar mass: 169.95 g/mol
Exact mass: 170.0551 Da
logP: -0.49Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Identifiers

CAS number

149507-26-6

SMILES

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

InChIKey

IILGLPAJXQMKGQ-UHFFFAOYSA-N

InChI

InChI=1S/C7H8BFO3/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,10-11H,1H3

Weigh it out

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

Names and synonyms

1 names

3-Fluoro-4-methoxyphenylboronic acid

Work with 3-Fluoro-4-methoxybenzeneboronic 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

3,4-Dimethoxyphenylboronic acid122775-35-373 % similar (3,4-Difluorophenyl)boronic acid168267-41-263 % similar B-(4-Chloro-3-methoxyphenyl)boronic acid89694-47-360 % similar 3-Fluoro-4-methoxyphenol452-11-956 % similar (3-Formyl-4-methoxyphenyl)boronic acid121124-97-855 % similar B-(3-Ethoxy-4-fluorophenyl)boronic acid900174-65-455 % similar 4-Benzyloxy-3-fluorophenylboronic Acid133057-83-755 % similar 2,4-Difluoroanisole452-10-855 % similar

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

Same formula

(2-Fluoro-4-methoxyphenyl)boronic acid162101-31-7 5-Fluoro-2-methoxyphenylboronic acid179897-94-0 4-Fluoro-2-methoxyphenylboronic acid179899-07-1 2-Fluoro-3-methoxyphenylboronic acid352303-67-4 2-Fluoro-5-methoxyphenylboronic acid406482-19-7 4-Fluoro-3-methoxyphenylboronic acid854778-31-7

Elsewhere

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