Trivinylboroxin pyridine complex

Product Information

Molecular Formula:
C11H14B3NO3
Molecular Weight:
240.67
Description
Reagent used for• Suzuki-Miyaura cross-coupling• Stereoselective synthesis via Palladium-catalyzed carboamination • Alkyl-connected 2-amino-6-vinylpurine (AVP) crosslinking agent to cytosine base in RNA • Kaiser oxime resin-derived palladacycle as a recoverable polymeric precatalyst in Suzuki-Miyaura cross-coupling reactions in aqueous media • Kinetic resolution of phosphoryl and sulfonyl esters of binaphthol derivatives via Pd-catalyzed alcoholysis of their vinyl ethers • Stereoselective isomerization of N-allyl aziridines into Z-enamines by using rhodium hydride catalysis• Kinetic resolution of axially chiral biaryl derivatives via palladium/chiral diamine ligand-catalyzed alcoholysis • Transition metal-catalyzed alkenylation of aziridines, cycloaddition and thermal rearrangement reactions • Intramolecular Heck reaction strategy for synthesis of functionalized tetrahydroanthracenes Reagent used for Preparation of• BACE-1 inhibitors and SAR of cyclic sulfone hydroxyethylamines • Distorted spiropentanes • Small molecule bradykinin B2 receptor antagonists in angioedema therapy • Enol Ethers • Styryl cyclobutanone
Synonyms
O'SHEA'S REAGENT; VINYLBORONIC ANHYDRIDE PYRIDINE COMPLEX; AURORA KA-6778; AKOS BRN-0208; 2,4,6-TRIVINYLCYCLOTRIBOROXANE PYRIDINE; 2,4,6-TRIVINYLCYCLOTRIBOROXANE PYRIDINE COMPLEX; Vinylboronic anhydride pyridine
IUPAC Name
pyridine2,4,6-tris(ethenyl)-1,3,5,2,4,6-trioxatriborinane
Canonical SMILES
B1(OB(OB(O1)C=C)C=C)C=C.C1=CC=NC=C1
InChI
InChI=1S/C6H9B3O3.C5H5N/c1-4-7-10-8(5-2)12-9(6-3)11-71-2-4-6-5-3-1/h4-6H,1-3H21-5H
InChI Key
YLHJACXHRQQNQR-UHFFFAOYSA-N
Flash Point
176.0 °F - closed cup
Purity
95%
Appearance
White to dark yellow powder, solid, crystals, and/or chunks
Storage
−20°C

Safety Information

Hazards
H319
Precautionary Statement
P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
241.1252838 g/mol
Monoisotopic Mass
241.1252838 g/mol
Topological Polar Surface Area
40.6Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
182
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021207186-A1 Cd38 inhibitors 2020-04-07
CA-3103120-A1 Chemical compounds 2019-12-20
US-2021188829-A1 Chemical Compounds 2019-12-20
WO-2021124155-A1 Benzimidazole derivatives 2019-12-20
WO-2020126952-A1 Imidazopyrazine derivatives as antibacterial agents 2018-12-17
WO-2020126953-A1 Novel imidazopyrazine derivatives as antibacterials 2018-12-17
WO-2020126954-A1 Novel imidazopyrazine derivatives 2018-12-17
WO-2020126956-A1 Imidazopyrazine derivatives as antibacterial agents 2018-12-17
WO-2020127075-A1 Imidazopyrazine derivatives as antibacterials 2018-12-17
EP-3897839-A1 Imidazopyrazine derivatives as antibacterial agents 2018-12-17

Literatures

PMID Publication Date Title Journal
7280 1976-02-01 [In vitro inhibition of oxidative N-demethylation with carbon disulfide] Arzneimittel-Forschung
The molarity calculator equation

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

The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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