(2-Phenoxyphenyl)boronic acid

C₁₂H₁₁BO₃CAS 108238-09-1214.03 g/mol

Open in Covalent MOL file

Boronic acid Ether

Properties

Molecular formula: C₁₂H₁₁BO₃
Molar mass: 214.03 g/mol
Exact mass: 214.0801 Da
logP: 1.16Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Identifiers

CAS number

108238-09-1

SMILES

B(C1=CC=CC=C1OC2=CC=CC=C2)(O)O

InChIKey

AVOWPOFIQZSVGV-UHFFFAOYSA-N

InChI

InChI=1S/C12H11BO3/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10/h1-9,14-15H

Weigh it out

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

Names and synonyms

1 names

2-Phenoxyphenylboronic acid

Work with (2-Phenoxyphenyl)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-Methoxyphenylboronic acid5720-06-957 % similar B-4-Phenoxathiinylboronic acid100124-07-046 % similar 2-Fluorodiphenyl ether124330-20-745 % similar 2-Phenoxyaniline2688-84-845 % similar Diphenyl ether101-84-844 % similar 1,4-Diphenoxybenzene3061-36-742 % similar 2-Methylphenylboronic acid16419-60-642 % similar B-(2-Aminophenyl)boronic acid5570-18-342 % similar

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

Elsewhere

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