2,2'-Bi-1,3,2-dioxaborinane

Name: 2,2'-Bi-1,3,2-dioxaborinane
Brand: BOC Sciences
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Molecular Formula:

C6H12B2O4

Molecular Weight:

169.78

CAS Number:

13826-25-0

Catalog Number:

BPM-367163

Product Information

Molecular Formula

C6H12B2O4

Molecular Weight

169.78

Description

As reported by the laboratory of James Morken, B2(pro)2 is an effective reagent for enantioselective diboration of alkenes when used in conjunction with the carbohydrate-derived catalysts TBS-DHG (901235) or DHR (901237). Useful for synthesis of other boron-containing molecules.

Synonyms

B2(pro)2,Propanediol diboron

IUPAC Name

2-(1,3,2-dioxaborinan-2-yl)-1,3,2-dioxaborinane

Canonical SMILES

B1(OCCCO1)B2OCCCO2

InChI

InChI=1S/C6H12B2O4/c1-3-9-7(10-4-1)8-11-5-2-6-12-8/h1-6H2

InChI Key

FOGDFVUQHQEIPV-UHFFFAOYSA-N

Melting Point

156 °C

Flash Point

Not applicable

Purity

≥95%

Storage

−20°C

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

170.0921692 g/mol

Monoisotopic Mass

170.0921692 g/mol

Topological Polar Surface Area

36.9Å²

Heavy Atom Count

Formal Charge

Complexity

118

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

The molarity calculator equation

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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2,2'-Bi-1,3,2-dioxaborinane

Product Information

Computed Properties

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