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2-Methoxy-3-pyridinylboronic acid MIDA ester

2-Methoxy-3-pyridinylboronic acid MIDA ester

Name: 2-Methoxy-3-pyridinylboronic acid MIDA ester
Brand: BOC Sciences
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Molecular Formula:

C11H13BN2O5

Molecular Weight:

264.04

Product Information

Molecular Formula:

C11H13BN2O5

Molecular Weight:

264.04

Description

Suzuki Cross-Coupling with MIDA Boronates

Synonyms

2-(2-Methoxypyridin-3-yl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione,2-Methoxy-3-pyridineboronic acid MIDA ester

IUPAC Name

1-(2-methoxypyridin-3-yl)-5-methyl-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione

Canonical SMILES

[B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=C(N=CC=C3)OC

InChI

InChI=1S/C11H13BN2O5/c1-14-6-9(15)18-12(14,19-10(16)7-14)8-4-3-5-13-11(8)17-2/h3-5H,6-7H2,1-2H3

InChI Key

BZDUXFKYSALIDL-UHFFFAOYSA-N

Melting Point

218-222 °C

Purity

97%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

264.0917517 g/mol

Monoisotopic Mass

264.0917517 g/mol

Topological Polar Surface Area

74.7Å²

Heavy Atom Count

Formal Charge

Complexity

409

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

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Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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2-Methoxy-3-pyridinylboronic acid MIDA ester

Product Information

Computed Properties

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