2-Cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

Base Information

Chemical Name:2-Cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
CAS No.:117311-84-9
Molecular Formula:C₁₀H₁₆BNO₄
Molecular Weight:225.052
Hs Code.:
DSSTox Substance ID:DTXSID90554385
Wikidata:Q82435352
Mol file:117311-84-9.mol

Synonyms:117311-84-9;2-cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione;Cyclopentylboronic acid MIDA ester;Boron, [N-[(carboxy-kappaO)methyl]-N-methylglycinato(2-)-kappaN,kappaO]cyclopentyl-, (T-4)-;DTXSID90554385;Cyclopentylboronic acid MIDA ester, 97%;G64466

Suppliers and Price of 2-Cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

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

Sigma-Aldrich
Cyclopentylboronic acid MIDA ester 97%
5g
$ 98.60

American Custom Chemicals Corporation
CYCLOPENTYLBORONIC ACID MIDA ESTER 95.00%
1G
$ 656.46

Total 8 raw suppliers

Chemical Property of 2-Cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

Chemical Property:

Melting Point:134-144 °C
PSA：55.84000
LogP:0.38850
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:225.1172382
Heavy Atom Count:16
Complexity:271

Purity/Quality:

98%,99%, ^*data from raw suppliers

Cyclopentylboronic acid MIDA ester 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B1(OC(=O)CN(CC(=O)O1)C)C2CCCC2
Uses Representative Applications of MIDA boronates

Technology Process of 2-Cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

There total 1 articles about 2-Cyclopentyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione 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: 90.0%

: 4408-64-4
N-methyliminodiacetic acid

: 41156-60-9
dimethyl cyclopentylboronate

: 117311-84-9
C₅H₉B(C₄H₄O₄NCH₃)

Guidance literature:: In tetrahydrofuran; dimethyl sulfoxide; addn. of 1 M soln. of C5H11B(OCH3)2 in THF to N-methyliminodiacetic acid in DMSO, stirring at 80-100°C for 2 h; control of completion of the reaction by (11)B-NMR, removing of solvent under vacuum (1-2.0 mm), treating with methanol, filtration, washing with ether;
DOI:10.1016/0022-328X(88)89064-8