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
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 |
