Dibenzo[B,D]furan-3-ylboronic acid

C₁₂H₉BO₃CAS 395087-89-5212.01 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₉BO₃
Molar mass: 212.01 g/mol
Exact mass: 212.0645 Da
logP: 1.27Crippen estimate
Polar surface area: 53.6 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

395087-89-5

SMILES

B(C1=CC2=C(C=C1)C3=CC=CC=C3O2)(O)O

InChIKey

FQENSZQWKVWYPA-UHFFFAOYSA-N

InChI

InChI=1S/C12H9BO3/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)16-12(10)7-8/h1-7,14-15H

Weigh it out

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

Work with Dibenzo[B,D]furan-3-ylboronic 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

Benzo[b]naphtho[2,3-d]furan-2-boronic acid1627917-17-265 % similar (3-(Dibenzo[B,D]furan-4-yl)phenyl)boronic acid1271726-52-355 % similar Dibenzofuran132-64-952 % similar 3-Bromodibenzofuran26608-06-050 % similar 3-Dibenzofuranamine4106-66-550 % similar 9,10-Diphenylanthracene-2-boronic Acid597553-98-550 % similar 2-Naphthylboronic acid32316-92-047 % similar Dibenzothiophene-2-boronic acid668983-97-946 % similar

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

Same formula

Dibenzofuran-4-boronic acid100124-06-9 B-1-Dibenzofuranylboronic acid162607-19-4 Dibenzo(b,d)furan-2-ylboronic Acid (contains varying amounts of Anhydride)402936-15-6

Elsewhere

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