3-Fluorophenylboronic acid MIDA ester

Base Information

Chemical Name:3-Fluorophenylboronic acid MIDA ester
CAS No.:1313614-50-4
Molecular Formula:C11H11BFNO4
Molecular Weight:251.022
Hs Code.:
European Community (EC) Number:693-383-4
DSSTox Substance ID:DTXSID20693630
Nikkaji Number:J3.452.887J
Wikidata:Q82622642
Mol file:1313614-50-4.mol

Synonyms:3-Fluorophenylboronic acid MIDA ester;1313614-50-4;2-(3-Fluorophenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;1311484-55-5;DTXSID20693630;3-FluorophenylboronicacidMIDAester;BEIIVLQOKBPWDE-UHFFFAOYSA-N;3-Fluorophenylboronic acid MIDA ester, 97%;3-(3-Fluorophenyl)-7-methyl-2,4-dioxa-3-bora-7-azacyclooctane-1,5-dione

Suppliers and Price of 3-Fluorophenylboronic acid MIDA ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
3-Fluorophenylboronic acid MIDA ester 97%
5g
$ 143.00

Sigma-Aldrich
3-Fluorophenylboronic acid MIDA ester 97%
1g
$ 16.50

Total 6 raw suppliers

Chemical Property of 3-Fluorophenylboronic acid MIDA ester

Chemical Property:

Melting Point:189-194°C
PSA：55.84000
LogP:-0.50940
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:251.0765162
Heavy Atom Count:18
Complexity:321

Purity/Quality:

99%,98%, ^*data from raw suppliers

3-Fluorophenylboronic acid MIDA ester 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B1(OC(=O)CN(CC(=O)O1)C)C2=CC(=CC=C2)F
Uses Suzuki Cross-Coupling with MIDA Boronates

Technology Process of 3-Fluorophenylboronic acid MIDA ester

There total 1 articles about 3-Fluorophenylboronic acid MIDA ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.0%

: 4408-64-4
N-methyliminodiacetic acid

: 768-35-4
3-fluorophenylboronic acid

: 1313614-50-4
C₁₁H₁₁BFNO₄

Guidance literature:: In acetonitrile; at 130 ℃; for 0.0833333h; under 12929 Torr; Solvent; Microwave irradiation;
DOI:10.1016/j.tet.2014.09.044

Reference yield:

: 1313614-50-4
C₁₁H₁₁BFNO₄

: C₂₃H₁₈Br₂O₆

: C₂₉H₂₂BrFO₆

: C₂₉H₂₂BrFO₆

Guidance literature:: With potassium phosphate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; (S)-(1,1'-binaphthalene)-2,2'-diylbis(diphenylphosphine); In tetrahydrofuran; water; at 65 ℃; for 18h; regioselective reaction; Inert atmosphere;
DOI:10.1002/anie.201101147

Reference yield:

: 1313614-50-4
C₁₁H₁₁BFNO₄

: C₂₃H₁₈Br₂O₆

: C₃₅H₂₆FNO₈

Guidance literature:: Multi-step reaction with 2 steps

1: tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; potassium phosphate; (S)-(1,1'-binaphthalene)-2,2'-diylbis(diphenylphosphine) / tetrahydrofuran; water / 18 h / 65 °C / Inert atmosphere

2: tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate / tetrahydrofuran; water / 1 h / 100 °C / Inert atmosphere; Microwave irradiation

With potassium phosphate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate; (S)-(1,1'-binaphthalene)-2,2'-diylbis(diphenylphosphine); In tetrahydrofuran; water; 2: Suzuki coupling;
DOI:10.1002/anie.201101147