(3,5-Bis(methoxycarbonyl)phenyl)boronic acid

Base Information

Chemical Name:(3,5-Bis(methoxycarbonyl)phenyl)boronic acid
CAS No.:177735-55-6
Molecular Formula:C10H11BO6
Molecular Weight:238.005
Hs Code.:2931900090
European Community (EC) Number:812-083-8
DSSTox Substance ID:DTXSID90598385
Wikidata:Q82494136
Mol file:177735-55-6.mol

Synonyms:177735-55-6;3,5-Bis(methoxycarbonyl)phenylboronic acid;(3,5-Bis(methoxycarbonyl)phenyl)boronic acid;[3,5-Bis(methoxycarbonyl)phenyl]boronic acid;1,3-BENZENEDICARBOXYLIC ACID, 5-BORONO-, 1,3-DIMETHYL ESTER;MFCD11053854;3,5-Bis(methoxycarbonyl)benzeneboronic acid;3,5-di(methoxycarbonyl)phenylboronic acid;SCHEMBL8005266;DTXSID90598385;WEJWFDLAZSVCJK-UHFFFAOYSA-N;AMY29779;CHA73555;AKOS015851030;AB63068;CS-W000886;GS-5596;SY024038;DB-102240;(3,5-Bis(methoxycarbonyl)phenyl)boronicacid;3,5-Bis(methoxycarbonyl)phenyl boronic acid;3,5-bis-(Methoxycarbonyl)phenylboronic acid;C73375;[3,5-bis(methoxycarbonyl)phenyl]-dihydroxyborane;A881448;3,5-Bis(methoxycarbonyl)phenylboronic acid(contains varying amounts of Anhydride)

Suppliers and Price of (3,5-Bis(methoxycarbonyl)phenyl)boronic 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
3,5-Bis(methoxycarbonyl)phenylboronicacid
250mg
$ 90.00

Matrix Scientific
(3,5-Bis(methoxycarbonyl)phenyl)boronic acid 95+%
1g
$ 1428.00

Matrix Scientific
(3,5-Bis(methoxycarbonyl)phenyl)boronic acid 95+%
250mg
$ 643.00

Crysdot
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
5g
$ 317.00

Crysdot
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
10g
$ 525.00

Crysdot
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
25g
$ 970.00

Chemenu
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
1g
$ 100.00

Chemenu
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
25g
$ 825.00

Chemenu
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
10g
$ 478.00

Chemenu
(3,5-Bis(methoxycarbonyl)phenyl)boronicacid 95+%
250mg
$ 69.00

Total 39 raw suppliers

Chemical Property of (3,5-Bis(methoxycarbonyl)phenyl)boronic acid

Chemical Property:

Boiling Point:436.3±55.0 °C(Predicted)
PKA:6.94±0.10(Predicted)
PSA：93.06000
Density:1.33±0.1 g/cm3(Predicted)
LogP:-1.06040
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:238.0648682
Heavy Atom Count:17
Complexity:269

Purity/Quality:

97% ^*data from raw suppliers

3,5-Bis(methoxycarbonyl)phenylboronicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B(C1=CC(=CC(=C1)C(=O)OC)C(=O)OC)(O)O
Uses It is employed in the for the synthesis of 3,4-disubstituted coumarins via Pd-Catalyzed site-selective cross-coupling reactions.

Technology Process of (3,5-Bis(methoxycarbonyl)phenyl)boronic acid

There total 5 articles about (3,5-Bis(methoxycarbonyl)phenyl)boronic 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: 62.4%

: 67-56-1
methanol

: 172975-69-8
3,5-dimethylphenyl boronic acid

: 177735-55-6
(3,5-bis(methoxycarbonyl)phenyl)boronic acid

Guidance literature:: 3,5-dimethylphenyl boronic acid; With sodium hydroxide; In water; tert-butyl alcohol; at 40 ℃; for 3h;

methanol; With sulfuric acid; for 12h; Reflux;
DOI:10.1039/c8ce00103k

Reference yield:

: 51839-15-7
5-iodo-isophthalic acid dimethyl ester

: 177735-55-6
(3,5-bis(methoxycarbonyl)phenyl)boronic acid

Guidance literature:: Multi-step reaction with 2 steps

1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium acetate / dimethyl sulfoxide / 2 h / 80 °C

2: hydrogenchloride; sodium periodate / tetrahydrofuran; water / 17.5 h / 25 °C

With hydrogenchloride; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium periodate; potassium acetate; In tetrahydrofuran; water; dimethyl sulfoxide;
DOI:10.1039/c1ob05748k

Reference yield:

: 99-27-4
dimethyl 5-aminoisophthalate

: 177735-55-6
(3,5-bis(methoxycarbonyl)phenyl)boronic acid

Guidance literature:: Multi-step reaction with 3 steps

1: hydrogenchloride; potassium iodide; sodium nitrite / water; toluene / 13 h / -5 °C / Reflux

2: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium acetate / dimethyl sulfoxide / 2 h / 80 °C

3: hydrogenchloride; sodium periodate / tetrahydrofuran; water / 17.5 h / 25 °C

With hydrogenchloride; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium periodate; potassium acetate; potassium iodide; sodium nitrite; In tetrahydrofuran; water; dimethyl sulfoxide; toluene;
DOI:10.1039/c1ob05748k