3-Iodophenylboronic acid

Base Information

Chemical Name:3-Iodophenylboronic acid
CAS No.:221037-98-5
Molecular Formula:C6H6BIO2
Molecular Weight:247.828
Hs Code.:29319090
European Community (EC) Number:627-272-9
DSSTox Substance ID:DTXSID20370252
Nikkaji Number:J1.568.477A
Wikidata:Q72484344
Mol file:221037-98-5.mol

Synonyms:Boronicacid, (3-iodophenyl)- (9CI);

Suppliers and Price of 3-Iodophenylboronic 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-Iodophenylboronic acid
1g
$ 75.00

TRC
3-Iodophenylboronic acid
250mg
$ 55.00

Synthonix
3-Iodophenylboronic acid 97%
25g
$ 370.00

Synthonix
3-Iodophenylboronic acid 97%
1g
$ 20.00

Synthonix
3-Iodophenylboronic acid 97%
5g
$ 110.00

Synthonix
3-Iodophenylboronic acid 97%
10g
$ 170.00

Sigma-Aldrich
3-Iodophenylboronic acid ≥95%
5g
$ 149.00

Matrix Scientific
3-Iodophenylboronic acid 95+%
1g
$ 70.00

Matrix Scientific
3-Iodophenylboronic acid 95+%
10g
$ 269.00

Matrix Scientific
3-Iodophenylboronic acid 95+%
5g
$ 181.00

Total 49 raw suppliers

Chemical Property of 3-Iodophenylboronic acid

Chemical Property:

Appearance/Colour:White to light yellow crystal powder
Vapor Pressure:8.99E-06mmHg at 25°C
Melting Point:195-197 °C
Refractive Index:1.649
Boiling Point:358.8 °C at 760 mmHg
PKA:7.67±0.10(Predicted)
Flash Point:170.8 °C
PSA：40.46000
Density:1.95 g/cm³
LogP:-0.02900
Storage Temp.:0-6°C
Sensitive.:Light Sensitive
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:247.95056
Heavy Atom Count:10
Complexity:110

Purity/Quality:

97% ^*data from raw suppliers

3-Iodophenylboronic acid ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B(C1=CC(=CC=C1)I)(O)O
Uses Reactant involved in:Aerobic oxidative coupling with arenesCoupling with acetalsSynthesis of inhibitors of homoserine transacetylaseBoron-Heck arylation with alkenesN-arylationHeck reactions with electrophilic alkenes

Technology Process of 3-Iodophenylboronic acid

There total 3 articles about 3-Iodophenylboronic 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: 87.0%

: 626-00-6
1,3-Diiodobenzene

: 221037-98-5
(3-iodophenyl)boronic acid

Guidance literature:: With n-butyllithium; Triisopropyl borate; In tetrahydrofuran; diethyl ether; at -78 - 20 ℃; for 21h;

Reference yield:

: 688-74-4
boric acid tributyl ester

: 626-00-6
1,3-Diiodobenzene

: 221037-98-5
(3-iodophenyl)boronic acid

Guidance literature:: With magnesium;
DOI:10.1021/ja01623a044

Reference yield:

: 25723-55-1,541-70-8
phenylene-1,3-diammonium sulfate

: 221037-98-5
(3-iodophenyl)boronic acid

Guidance literature:: Multi-step reaction with 2 steps

1: sodium nitrite; potassium iodide; hydrogenchloride / water / 2 h / 0 - 20 °C

2: n-butyllithium; Triisopropyl borate / tetrahydrofuran; diethyl ether / 21 h / -78 - 20 °C

With hydrogenchloride; n-butyllithium; Triisopropyl borate; potassium iodide; sodium nitrite; In tetrahydrofuran; diethyl ether; water;