4-cyanopyridine-3-boronic acid neopentyl glycol ester

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Catalog Number

ACMA00015010

Product Name

4-cyanopyridine-3-boronic acid neopentyl glycol ester

Category

Salt

IUPAC Name

3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)pyridine-4-carbonitrile

Molecular Weight

216.05g/mol

Molecular Formula

C11H13BN2O2

Canonical SMILES

B1(OCC(CO1)(C)C)C2=C(C=CN=C2)C#N

InChI

InChI=1S/C11H13BN2O2/c1-11(2)7-15-12(16-8-11)10-6-14-4-3-9(10)5-13/h3-4,6H,7-8H2,1-2H3

InChI Key

LQJDIJNZYFYRPX-UHFFFAOYSA-N

Complexity

290

Covalently-Bonded Unit Count

Exact Mass

216.107008g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

216.107008g/mol

Rotatable Bond Count

MSDS

COA

Spec Sheet

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