4-Methylpyridine-2-boronic acid

C₆H₈BNO₂CAS 372963-48-9136.94 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

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

372963-48-9

SMILES

B(C1=NC=CC(=C1)C)(O)O

InChIKey

CGRJYCBMVWNLPD-UHFFFAOYSA-N

InChI

InChI=1S/C6H8BNO2/c1-5-2-3-8-6(4-5)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-2-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

4,4′-Dimethyl-2,2′-bipyridine1134-35-650 % similar 2-Fluoro-4-methylpyridine461-87-050 % similar 2,4-Lutidine108-47-448 % similar 2-Pyridineboronic acid197958-29-547 % similar 4-Methyl-2-pyridinecarbonitrile1620-76-445 % similar 2-Chloro-4-methylpyridine3678-62-445 % similar 2-Bromo-4-methylpyridine4926-28-745 % similar 3-Methylphenylboronic acid17933-03-844 % similar

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

Same formula

4-Methylpyridine-3-boronic acid148546-82-1 5-Methylpyridine-3-boronic acid173999-18-3 3-Aminophenylboronic acid30418-59-8 5-Methyl-2-pyridineboronic acid372963-49-0 6-Methylpyridine-2-boronic acid372963-50-3 B-(2-Aminophenyl)boronic acid5570-18-3 2-Methylpyridine-4-boronic acid579476-63-4 2-Methylpyridine-5-boronic acid659742-21-9

Elsewhere

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