2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile

Base Information

Chemical Name:2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile
CAS No.:883898-98-4
Molecular Formula:C13H13BF3NO2
Molecular Weight:283.0540296
Hs Code.:2934999090
DSSTox Substance ID:DTXSID00468227
Nikkaji Number:J2.307.654C
Mol file:883898-98-4.mol

Synonyms:2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile;883898-98-4;2-CYANO-4-TRIFLUOROMETHYLPHENYLBORONIC ACID NEOPENTYL GLYCOL ESTER;DTXSID00468227;MFCD08689554;AKOS015999763;AB48282;BS-25812;CS-0174075;F87709;A862211;2-CYANO-4-(TRIFLUOROMETHYL)BENZENEBORONIC ACID NEOPENTYL GLYCOL ESTER

Suppliers and Price of 2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile

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
2-Cyano-4-trifluoromethylphenylboronicacidneopentylglycolester
50mg
$ 95.00

SynQuest Laboratories
2-Cyano-4-(trifluoromethyl)benzeneboronic acid neopentyl glycol ester
250 mg
$ 384.00

SynQuest Laboratories
2-Cyano-4-(trifluoromethyl)benzeneboronic acid neopentyl glycol ester
1 g
$ 920.00

Matrix Scientific
2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile 95+%
1g
$ 1227.00

Matrix Scientific
2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile 95+%
250mg
$ 553.00

Crysdot
2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile 95+%
1g
$ 452.00

Chemenu
2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile 95%
1g
$ 427.00

American Custom Chemicals Corporation
2-CYANO-4-(TRIFLUOROMETHYL)BENZENEBORONIC ACID NEOPENTYL GLYCOL ESTER 95.00%
5MG
$ 499.28

Alichem
2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile
1g
$ 474.24

AK Scientific
2-Cyano-4-trifluoromethylphenylboronicacidneopentylglycolester
1g
$ 691.00

Total 14 raw suppliers

Chemical Property of 2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile

Chemical Property:

PSA：42.25000
LogP:2.34528
Storage Temp.:Refrigerated.
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:283.0991433
Heavy Atom Count:20
Complexity:394

Purity/Quality:

97% ^*data from raw suppliers

2-Cyano-4-trifluoromethylphenylboronicacidneopentylglycolester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B1(OCC(CO1)(C)C)C2=C(C=C(C=C2)C(F)(F)F)C#N

Technology Process of 2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile

There total 1 articles about 2-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile 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: 98.0%

: 5419-55-6
Triisopropyl borate

: 368-77-4
3-trifluoromethylbenzonitrile

: 126-30-7
2,2-Dimethyl-1,3-propanediol

: 883898-98-4
2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5-(trifluoromethyl)benzonitrile

Guidance literature:: Triisopropyl borate; 3-trifluoromethylbenzonitrile; With 2,2,6,6-tetramethylpiperidinyl-lithium; In tetrahydrofuran; hexane; at -78 - 20 ℃;

2,2-Dimethyl-1,3-propanediol; In tetrahydrofuran; hexane; at 20 ℃; for 1h;
DOI:10.1021/jo052400g