3,5-Dimethoxyphenylboronic acid

C₈H₁₁BO₄CAS 192182-54-0181.98 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

192182-54-0

SMILES

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

InChIKey

XUIURRYWQBBCCK-UHFFFAOYSA-N

InChI

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

(3,5-Dimethoxyphenyl)boronic acid

Work with 3,5-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

B-(3-Chloro-5-methoxyphenyl)boronic acid915201-07-971 % similar (4-Methoxyphenyl)boronic acid5720-07-062 % similar 2,4,6-Trimethoxyphenylboronic acid135159-25-057 % similar 3,4,5-Trimethoxybenzeneboronic acid182163-96-857 % similar 1,3,5-Trimethoxybenzene621-23-857 % similar 6-Methoxy-2-naphthaleneboronic acid156641-98-457 % similar [4-[Bis(4-methoxyphenyl)amino]phenyl]boronic Acid (contains varying amounts of Anhydride)201802-29-150 % similar 3,5-Dimethoxyphenol500-99-250 % 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 2,6-Dimethoxyphenylboronic acid23112-96-1

Elsewhere

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