Allylboronic Acid Pinacol Ester

Inquiry

Molecular Formula:

C9H17O2B

Molecular Weight:

168.04

CAS Number:

72824-04-5

Catalog Number:

72824-04-5

Product Information

Molecular Formula:

C9H17O2B

Molecular Weight:

168.04

Description

Reagent used for: Palladium-catalyzed Suzuki-Miyaura cross-coupling reactions and olefin metathesis ; Intermolecular radical additions ; Allylboration of aldehydes catalyzed by chiral spirobiindane diol (SPINOL) based phosphoric acids ; Cobalt-catalyzed regioselective hydrovinylation of dienes with alkenes ; Nucleic acid-templated energy transfer leading to a photorelease reaction ; Stereoselective indium-catalyzed Hosomi-Sakurai reactions Reagent used in Preparation of; Cyclic sulfone hydroxyethylamines as BACE1 inhibitors for reduction of Amyloid β-Peptides ; Transmetalation of carbene Ru iodide with Ag carboxylates to give C-H-activated Ru carbene complexes as catalysts for Z-selective olefin metathesis.

Synonyms

4,4,5,5-tetramethyl-2-prop-2-enyl-1,3,2-dioxaborolane; 4,4,5,5-tetramethyl-2-prop-2-enyl-1,3,2-dioxaborolane

IUPAC Name

4,4,5,5-tetramethyl-2-prop-2-enyl-1,3,2-dioxaborolane

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)CC=C

InChI

InChI=1S/C9H17BO2/c1-6-7-10-11-8(2,3)9(4,5)12-10/h6H,1,7H2,2-5H3

InChI Key

YMHIEPNFCBNQQU-UHFFFAOYSA-N

Boiling Point

50-53 °C / 5 mmHg (lit.)

Flash Point

114.8 °F - closed cup

Purity

97 %

Density

0.896 g/mL at 25 °C (lit.)

Storage

2-8 °C

Refractive Index

n20/D 1.4268 (lit.)

LogP

2.26460

Safety Information

Hazards

H226

Precautionary Statement

P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501

Signal Word

Warning

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

168.1321599 g/mol

Monoisotopic Mass

168.1321599 g/mol

Topological Polar Surface Area

18.5Å²

Heavy Atom Count

Formal Charge

Complexity

171

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
CN-114094174-A	Preparation method and application of self-repairing polymer electrolyte	2021-10-28
CN-113801424-A	Thermoplastic resin composite material for notebook computer bottom shell and manufacturing method thereof	2021-10-11
CN-113788813-A	Fluorescent dye capable of emitting in all visible light bands and preparation method and application thereof	2021-08-06
CN-113896700-A	Micromolecular formaldehyde fluorescent probe and application thereof	2021-07-02
CN-113201293-A	High-temperature-resistant adhesive tape	2021-05-26
CN-113387816-A	Formaldehyde catching agent and preparation method and application thereof	2021-04-28
CN-112164824-A	Anion receptor type single-ion conductor flame-retardant gel polymer electrolyte and preparation method thereof	2020-09-07
CN-112164824-B	Anion receptor type single-ion conductor flame-retardant gel polymer electrolyte and preparation method thereof	2020-09-07
CN-111793465-A	Organic silicon modified soybean gum adhesive and preparation method thereof	2020-08-18
CN-111793465-B	Organic silicon modified soybean gum adhesive and preparation method thereof	2020-08-18

Literatures

PMID	Publication Date	Title	Journal
20704395	2010-08-20	Use of N-allylidene-1,1-diphenylethanamine as a latent acrolein synthon in the double nucleophilic addition reaction of ketene silyl (Thio)acetals and allylborolanes	Organic letters

The molarity calculator equation

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

Mass

Concentration

Volume

Molecular Weight *

Calculate

The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)