4-Methylpyridine-3-boronic acid

C₆H₈BNO₂CAS 148546-82-1136.94 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₈BNO₂
Molar mass: 136.94 g/mol
Exact mass: 137.0648 Da
logP: -0.93Crippen estimate
Polar surface area: 53.4 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Identifiers

CAS number

148546-82-1

SMILES

B(C1=C(C=CN=C1)C)(O)O

InChIKey

ASXFMIDIRZPCGK-UHFFFAOYSA-N

InChI

InChI=1S/C6H8BNO2/c1-5-2-3-8-4-6(5)7(9)10/h2-4,9-10H,1H3

Weigh it out

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

Work with 4-Methylpyridine-3-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

B-(4-Chloro-3-pyridinyl)boronic acid452972-10-055 % similar 3,4-Dimethylpyridine583-58-452 % similar 2-Methylphenylboronic acid16419-60-652 % similar 4-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine1171891-31-851 % similar 3-Hydroxy-4-methylpyridine1121-19-350 % similar (3-Fluoropyridin-4-yl)boronic acid458532-97-350 % similar (3-Chloropyridin-4-yl)boronic acid458532-98-450 % similar B-(6-Chloro-4-methyl-3-pyridinyl)boronic acid913836-08-546 % similar

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

Same formula

5-Methylpyridine-3-boronic acid173999-18-3 3-Aminophenylboronic acid30418-59-8 B-(2-Aminophenyl)boronic acid5570-18-3

Elsewhere

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