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4,4'-BIPHENYLDIBORONIC ACID BIS(NEOPENTYL GLYCOL) ESTER

4,4'-BIPHENYLDIBORONIC ACID BIS(NEOPENTYL GLYCOL) ESTER

Inquiry

Molecular Formula:

C22H28B2O4

Molecular Weight:

378.08

CAS Number:

5487-93-4

Catalog Number:

5487-93-4

Product Information

Molecular Formula:

C22H28B2O4

Molecular Weight:

378.08

Description

4,4'-Biphenyldiboronic Acid Bis(Neopentyl Glycol) Ester is a pivotal chemical compound that finds its indispensability within the realm of the biomedical industry. By virtue of its multifaceted functionality, it assumes a critical position in the synthesis of compounds enriched with boron, which harbour vast potential for the development of pharmaceutical agents. The inherent power of this extraordinary entity lies in its capacity to precisely target distinct molecular pathways, thereby conferring it with the prowess to combat a plethora of ailments, not excluding cancer.

Synonyms

4,4-Biphenyldiboronic Acid Bis(neopentyl Glycol) Ester

IUPAC Name

2-[4-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]phenyl]-5,5-dimethyl-1,3,2-dioxaborinane

Canonical SMILES

CC1(C)COB(OC1)c2ccc(cc2)-c3ccc(cc3)B4OCC(C)(C)CO4

InChI

InChI=1S/C22H28B2O4/c1-21(2)13-25-23(26-14-21)19-9-5-17(6-10-19)18-7-11-20(12-8-18)24-27-15-22(3,4)16-28-24/h5-12H,13-16H2,1-4H3

InChI Key

NJXUWONHNYJPMY-UHFFFAOYSA-N

Melting Point

241-245 °C

Purity

>98.0%(GC)(T)

Safety Information

Hazards

H400

Precautionary Statement

P273

Signal Word

Warning

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

378.2173697 g/mol

Monoisotopic Mass

378.2173697 g/mol

Topological Polar Surface Area

36.9Å²

Heavy Atom Count

Formal Charge

Complexity

445

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

Patents

Publication Number	Title	Priority Date
EP-3764434-A1	Elimination of voltage-delays and stabilisation of impedance through electrolyte additives in alkaline metal chemical cells	2019-07-10
WO-2021004862-A1	Elimination of voltage delay and stabilization of impedance by electrolyte additives in alkali metal electrochemical cells	2019-07-10
EP-3385270-A1	Method for producing aromatic compound, and palladium complex	2015-12-02
JP-WO2017094655-A1	Method for producing aromatic compound and palladium complex	2015-12-02
US-2018369799-A1	Process for producing aromatic compound, and palladium complex	2015-12-02
WO-2017094655-A1	Method for producing aromatic compound, and palladium complex	2015-12-02
JP-6791166-B2	Method for producing aromatic compounds and palladium complex	2015-12-02
US-11045796-B2	Process for producing aromatic compound, and palladium complex	2015-12-02
JP-5896028-B2	Method for producing polyhydric alcohol ether	2012-08-09
JP-WO2014024717-A1	Method for producing polyhydric alcohol ether	2012-08-09

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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