4-Fluorophenylboronic acid neopentylglycol ester

Inquiry

Molecular Formula:

C11H14BFO2

Molecular Weight:

208.04

CAS Number:

225916-39-2

Catalog Number:

225916-39-2

Product Information

Molecular Formula:

C11H14BFO2

Molecular Weight:

208.04

Description

4-Fluorophenylboronic acid neopentylglycol ester is an invaluable biomedical entity. Enabled by its profound inhibitory capabilities against peculiar proteins implicated in malignant cellular proliferation, it exhibits exceptional promise in combating renitent cohorts grappling with breast, lung, and prostate cancers.

Synonyms

2-(4-Fluorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane

IUPAC Name

2-(4-fluorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane

Canonical SMILES

B1(OCC(CO1)(C)C)C2=CC=C(C=C2)F

InChI

InChI=1S/C11H14BFO2/c1-11(2)7-14-12(15-8-11)9-3-5-10(13)6-4-9/h3-6H,7-8H2,1-2H3

InChI Key

GWWSSPCPSWVJRZ-UHFFFAOYSA-N

Melting Point

64-68 °C (lit.)

Flash Point

Not applicable

Purity

97%

Storage

2-8°C

Safety Information

Hazards

H302 - H315 - H319 - H335

Precautionary Statement

P301 + P312 + P330 - P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

208.1070880 g/mol

Monoisotopic Mass

208.1070880 g/mol

Topological Polar Surface Area

18.5Å²

Heavy Atom Count

Formal Charge

Complexity

205

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
JP-2018515438-A	Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer and methods of using them	2015-04-03
JP-2018516238-A	Indoleamine-2,3-dioxygenase inhibitors for the treatment of cancer and methods of their use	2015-04-03
JP-2018519245-A	Indoleamine-2,3-dioxygenase inhibitors for the treatment of cancer and methods of their use	2015-04-03
KR-20170134980-A	Inhibitor of indoleamine-2,3-dioxygenase for the treatment of cancer	2015-04-03
KR-20170134981-A	Inhibitor of indoleamine-2,3-dioxygenase for the treatment of cancer	2015-04-03
KR-20170136557-A	Inhibitor of indoleamine-2,3-dioxygenase for the treatment of cancer	2015-04-03
US-10167254-B2	IDO inhibitors	2015-04-03
US-10399932-B2	Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer	2015-04-03
US-10399933-B2	Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer	2015-04-03

The molarity calculator equation

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

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The dilution calculator equation

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This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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