3-Isopropoxy-5-methylphenylboronic acid

Base Information

Chemical Name:3-Isopropoxy-5-methylphenylboronic acid
CAS No.:1256345-76-2
Molecular Formula:C10H15BO3
Molecular Weight:194.0353
Hs Code.:2931900090
DSSTox Substance ID:DTXSID10681566
Wikidata:Q82605648
Mol file:1256345-76-2.mol

Synonyms:1256345-76-2;3-ISOPROPOXY-5-METHYLPHENYLBORONIC ACID;(3-Isopropoxy-5-methylphenyl)boronic acid;(3-methyl-5-propan-2-yloxyphenyl)boronic acid;DTXSID10681566;MFCD16295054;AKOS006337069;(3-Isopropoxy-5-methylphenyl)boronicacid;BS-19752;CS-0174520;E97839;[3-methyl-5-(propan-2-yloxy)phenyl]boronic acid;{3-Methyl-5-[(propan-2-yl)oxy]phenyl}boronic acid

Suppliers and Price of 3-Isopropoxy-5-methylphenylboronic 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

Crysdot
(3-Isopropoxy-5-methylphenyl)boronicacid 95+%
5g
$ 452.00

American Custom Chemicals Corporation
(3-ISOPROPOXY-5-METHYLPHENYL)BORONIC ACID 95.00%
1G
$ 327.60

Alichem
(3-Isopropoxy-5-methylphenyl)boronicacid
5g
$ 474.24

AK Scientific
3-Isopropoxy-5-methylphenylboronicacid
5g
$ 691.00

Total 14 raw suppliers

Chemical Property of 3-Isopropoxy-5-methylphenylboronic acid

Chemical Property:

PSA：49.69000
LogP:0.46200
Storage Temp.:Refrigerated.
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:194.1114245
Heavy Atom Count:14
Complexity:173

Purity/Quality:

98%min ^*data from raw suppliers

(3-Isopropoxy-5-methylphenyl)boronicacid 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B(C1=CC(=CC(=C1)OC(C)C)C)(O)O

Technology Process of 3-Isopropoxy-5-methylphenylboronic acid

There total 3 articles about 3-Isopropoxy-5-methylphenylboronic 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:

: 889659-70-5
3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

: 75-26-3
isopropyl bromide

: 1256345-76-2
(3-isopropoxy-5-methylphenyl)boronic acid

Guidance literature:: 3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol; isopropyl bromide; With potassium carbonate; In N,N-dimethyl-formamide; at 90 ℃;

With sodium periodate; In tetrahydrofuran; water; for 0.25h;

With hydrogenchloride; In tetrahydrofuran; water; at 20 ℃; for 4h;
DOI:10.1021/jacs.6b00356

Reference yield:

: 504-15-4
orcinol

: 1256345-76-2
(3-isopropoxy-5-methylphenyl)boronic acid

Guidance literature:: Multi-step reaction with 3 steps

1.1: 2,6-dimethylpyridine; dmap / dichloromethane / 3 h / 0 - 20 °C

2.1: methanesulfonic acid(2-dicyclohexylphosphino-2′,4′,6′-triisopropyl-1,1′-biphenyl)[2-(2′-amino-1,1′-biphenyl)]palladium(II); potassium acetate / toluene; 1,4-dioxane / 16 h / 95 °C / Inert atmosphere

3.1: potassium carbonate / N,N-dimethyl-formamide / 90 °C

3.2: 0.25 h

3.3: 4 h / 20 °C

With 2,6-dimethylpyridine; dmap; methanesulfonic acid(2-dicyclohexylphosphino-2′,4′,6′-triisopropyl-1,1′-biphenyl)[2-(2′-amino-1,1′-biphenyl)]palladium(II); potassium acetate; potassium carbonate; In 1,4-dioxane; dichloromethane; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jacs.6b00356

Reference yield:

: 889659-69-2
3-hydroxy-5-methylphenyl trifluoromethanesulfonate

: 1256345-76-2
(3-isopropoxy-5-methylphenyl)boronic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: methanesulfonic acid(2-dicyclohexylphosphino-2′,4′,6′-triisopropyl-1,1′-biphenyl)[2-(2′-amino-1,1′-biphenyl)]palladium(II); potassium acetate / toluene; 1,4-dioxane / 16 h / 95 °C / Inert atmosphere

2.1: potassium carbonate / N,N-dimethyl-formamide / 90 °C

2.2: 0.25 h

2.3: 4 h / 20 °C

With methanesulfonic acid(2-dicyclohexylphosphino-2′,4′,6′-triisopropyl-1,1′-biphenyl)[2-(2′-amino-1,1′-biphenyl)]palladium(II); potassium acetate; potassium carbonate; In 1,4-dioxane; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jacs.6b00356