2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine

Base Information

Chemical Name:2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine
CAS No.:205116-75-2
Molecular Formula:C14H25BClNO2
Molecular Weight:349.278
Hs Code.:2934999090
DSSTox Substance ID:DTXSID70700681
Mol file:205116-75-2.mol

Synonyms:205116-75-2;2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine;2-(2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl)pyrrolidine;2-(2,9,9-Trimethyl-3,5-dioxa-4-bora-tricyclo[6.1.1.02,6]dec-4-yl)-pyrrolidine;SCHEMBL12658544;DTXSID70700681;AKOS015995059;A879590;J-505508;2-(3a,5,5-Trimethylhexahydro-2H-4,6-methano-1,3,2-benzodioxaborol-2-yl)pyrrolidine

Suppliers and Price of 2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine

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
2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine 95+%
1g
$ 880.00

Alichem
2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine
1g
$ 785.40

Total 6 raw suppliers

Chemical Property of 2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine

Chemical Property:

PSA：30.49000
LogP:2.75460
Storage Temp.:2-8°C
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:249.1900092
Heavy Atom Count:18
Complexity:375

Purity/Quality:

97% ^*data from raw suppliers

2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B1(OC2CC3CC(C3(C)C)C2(O1)C)C4CCCN4

Technology Process of 2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine

There total 1 articles about 2-(3a,5,5-Trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborol-2-yl)pyrrolidine 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:

: 86953-79-9
tert-butyl pyrrolidine-1-carboxylate

: 205116-75-2
(1S,2S,3R,5S)-pinane-2,3-diyl (N-(1,1-dimethylethoxycarbonyl)pyrrolidin-2-yl)boronate

Guidance literature:: Multi-step reaction with 2 steps

1.1: s-BuLi; TMEDA / diethyl ether / 4 h / -78 °C

1.2: 27 percent / triisopropyl borate / diethyl ether / -78 - 20 °C

2.1: 97 percent / CHCl₃ / 12 h

With N,N,N,N,-tetramethylethylenediamine; sec.-butyllithium; In diethyl ether; chloroform;
DOI:10.1021/jo0708792

Reference yield: 33.0%

: 7647-01-0,15364-23-5
hydrogenchloride

: 205116-75-2
(1S,2S,3R,5S)-pinane-2,3-diyl (N-(1,1-dimethylethoxycarbonyl)pyrrolidin-2-yl)boronate

: 149716-72-3
(RS)-proline boronic acid-(1S,2S,3R,5S)-(+)-2,3-pinanediol ester hydrochloride

Guidance literature:: hydrogenchloride; (1S,2S,3R,5S)-pinane-2,3-diyl (N-(1,1-dimethylethoxycarbonyl)pyrrolidin-2-yl)boronate; In diethyl ether; at 0 - 20 ℃; for 3.5h;

With O,O'-dibenzoyl-L-tartaric acid; at 55 ℃; for 1h;