2,6-Dimethoxyphenylboronic acid

C₈H₁₁BO₄CAS 23112-96-1181.98 g/mol

Open in Covalent MOL file

Boronic acid Ether

Properties

Molecular formula: C₈H₁₁BO₄
Molar mass: 181.98 g/mol
Exact mass: 182.0750 Da
logP: -0.62Crippen estimate
Polar surface area: 58.9 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3

Identifiers

CAS number

23112-96-1

SMILES

B(C1=C(C=CC=C1OC)OC)(O)O

InChIKey

BKWVXPCYDRURMK-UHFFFAOYSA-N

InChI

InChI=1S/C8H11BO4/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5,10-11H,1-2H3

Weigh it out

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

Names and synonyms

1 names

(2,6-Dimethoxyphenyl)boronic acid

Work with 2,6-Dimethoxyphenylboronic 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

2,4,6-Trimethoxyphenylboronic acid135159-25-061 % similar 2-Methoxyphenylboronic acid5720-06-961 % similar (2-Methoxy-1-naphthyl)boronic acid104116-17-859 % similar 2-Fluoro-3-methoxyphenylboronic acid352303-67-456 % similar Syringol91-10-152 % similar 1,2,3-Trimethoxybenzene634-36-650 % similar 1,2-Dimethoxybenzene91-16-750 % similar 3-Methoxynaphthalene-2-boronic acid104115-76-648 % similar

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

Same formula

2,5-Dimethoxyphenylboronic acid107099-99-0 3,4-Dimethoxyphenylboronic acid122775-35-3 2,4-Dimethoxybenzeneboronic acid133730-34-4 3,5-Dimethoxyphenylboronic acid192182-54-0

Elsewhere

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