4-(Bromomethyl)phenylboronic acid

Base Information

Chemical Name:4-(Bromomethyl)phenylboronic acid
CAS No.:68162-47-0
Molecular Formula:C7H8BBrO2
Molecular Weight:214.854
Hs Code.:29319090
European Community (EC) Number:627-358-6
DSSTox Substance ID:DTXSID20370818
Nikkaji Number:J1.694.615J
Wikidata:Q72447627
Mol file:68162-47-0.mol

Synonyms:68162-47-0;4-(Bromomethyl)phenylboronic acid;4-bromomethylphenylboronic acid;(4-(Bromomethyl)phenyl)boronic acid;[4-(bromomethyl)phenyl]boronic Acid;4-(bromomethyl)benzeneboronic acid;MFCD01318113;Boronic acid, [4-(bromomethyl)phenyl]-;4-Bromomethylbenzeneboronic acid;(4-bromomethylphenyl)boronic acid;4-Boronobenzyl bromide;4-(Bromomethyl)phenylboronicacid;SCHEMBL40256;P-BORONOBENZYL BROMIDE;4-(Bromomethyl)phenylboronic acid, cyclic anhydride;4-bromomethylphenyl boronic acid;DTXSID20370818;p-Bromomethylbenzene Boronic Acid;PDNOURKEZJZJNZ-UHFFFAOYSA-N;(4-(Bromomethyl)phenyl)boronicacid;AKOS015836208;AB08630;AC-9222;CS-W000960;PS-9528;ALPHA-BROMO-P-TOLUENEBORONIC ACID;SY014690;A9092;AM20060340;FT-0616717;EN300-150254;J-514827;Z1269236418

Suppliers and Price of 4-(Bromomethyl)phenylboronic acid

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

TRC
4-(Bromomethyl)phenylboronic acid
100mg
$ 45.00

Synthonix
4-(Bromomethyl)phenylboronic acid 96%
100g
$ 410.00

Synthonix
4-(Bromomethyl)phenylboronic acid 96%
10g
$ 60.00

Synthonix
4-(Bromomethyl)phenylboronic acid 96%
25g
$ 130.00

Synthonix
4-(Bromomethyl)phenylboronic acid 96%
1g
$ 15.00

Synthonix
4-(Bromomethyl)phenylboronic acid 96%
5g
$ 40.00

SynQuest Laboratories
4-(Bromomethyl)benzeneboronic acid
5 g
$ 39.00

SynQuest Laboratories
4-(Bromomethyl)benzeneboronic acid
1 g
$ 16.00

SynQuest Laboratories
4-(Bromomethyl)benzeneboronic acid
25 g
$ 149.00

Sigma-Aldrich
4-(Bromomethyl)phenylboronic acid
5g
$ 288.00

Total 120 raw suppliers

Chemical Property of 4-(Bromomethyl)phenylboronic acid

Chemical Property:

Appearance/Colour:cream-colored crystalline powder
Vapor Pressure:2.75E-05mmHg at 25°C
Melting Point:78-81°C
Refractive Index:1.582
Boiling Point:343.1 °C at 760 mmHg
PKA:8.51±0.17(Predicted)
Flash Point:161.3 °C
PSA：40.46000
Density:1.57 g/cm³
LogP:0.26130
Storage Temp.:2-8°C
Solubility.:DMSO (Slightly), Methanol (Slightly)
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:213.98007
Heavy Atom Count:11
Complexity:113

Purity/Quality:

99% ^*data from raw suppliers

4-(Bromomethyl)phenylboronic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi,Xn
Hazard Codes:Xi,Xn
Statements: 22-36/37/38-20/21/22
Safety Statements: 26-36/37-36-36/37/39-22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B(C1=CC=C(C=C1)CBr)(O)O
Uses Reactant involved in:Design of boronic acid-based autotaxin inhibitorsSynthesis of boronated phosphonium saltsStudies of incorporation of boronic acid groups to enhance gene transfection capabilityInvestigations of the effect of boronic acid-positioning in optical glucose-sensing ensemble Reactant involved in:? ;Design of boronic acid-based autotaxin inhibitors1? ;Synthesis of boronated phosphonium salts2? ;Studies of incorporation of boronic acid groups to enhance gene transfection capability2? ;Investigations of the effect of boronic acid-positioning in optical glucose-sensing ensemble3 suzuki reaction

Technology Process of 4-(Bromomethyl)phenylboronic acid

There total 4 articles about 4-(Bromomethyl)phenylboronic acid 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: 86.9%

: 68162-47-0
4-bromomethylphenylboronic acid

Guidance literature:: With bromine; In tetrachloromethane; for 2h; Irradiation;

Reference yield: 46.0%

: 5720-05-8
4-methylphenylboronic acid

: 68162-47-0
4-bromomethylphenylboronic acid

Guidance literature:: With N-Bromosuccinimide; lead(II) oxide; In tetrachloromethane; for 12h; Heating;
DOI:10.1021/ol049605g

Reference yield:

: 106-38-7
para-bromotoluene

: 68162-47-0
4-bromomethylphenylboronic acid

Guidance literature:: Multi-step reaction with 3 steps

1.1: Mg / tetrahydrofuran / 1 h / Heating

1.2: tetrahydrofuran / 1 h / -10 °C

2.1: aq. H₂SO₄ / tetrahydrofuran

3.1: 46 percent / NBS; PBO / CCl₄ / 12 h / Heating

With N-Bromosuccinimide; sulfuric acid; lead(II) oxide; magnesium; In tetrahydrofuran; tetrachloromethane;
DOI:10.1021/ol049605g