4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide

Base Information

Chemical Name:4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide
CAS No.:480427-57-4
Molecular Formula:C56H66N4O2.2Br
Molecular Weight:986.971
Hs Code.:
European Community (EC) Number:634-888-1
DSSTox Substance ID:DTXSID50583358
Mol file:480427-57-4.mol

4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide

Synonyms:480427-57-4;4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide;DTXSID50583358;O,O'-diallyl-N,N'-(2,7-naphthalenediyldimethyl)bis(hydrocinchonidinium)dibromide

Suppliers and Price of 4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide

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
O,O′-Diallyl-N,N′-(2,7-naphthalenediyldimethyl)bis(hydrocinchonidinium) dibromide ≥97.0%
100mg-f
$ 138.00

American Custom Chemicals Corporation
O,O'-DIALLYL-N,N'-(2,7-NAPHTHALENEDIYLDIMETHYL)BIS(HYDROCINCHONIDINIUM) DIBROMIDE 95.00%
5MG
$ 496.91

Total 6 raw suppliers

Chemical Property of 4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide

Chemical Property:

Melting Point:194 °C (decomp)(Solv: dichloromethane (75-09-2); hexane (110-54-3))
Storage Temp.:2-8°C
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:16
Exact Mass:986.35320
Heavy Atom Count:64
Complexity:1490

Purity/Quality:

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

O,O′-Diallyl-N,N′-(2,7-naphthalenediyldimethyl)bis(hydrocinchonidinium) dibromide ≥97.0% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26

MSDS Files:

Useful:

Canonical SMILES:CCC1CC2CC[N+]1(CC2C(C3=CC=NC4=CC=CC=C34)OCC=C)CC5=CC6=C(C=C5)C=CC(=C6)C[N+]78CCC(CC7C(C9=CC=NC1=CC=CC=C91)OCC=C)C(C8)CC.[Br-].[Br-]
Isomeric SMILES:CCC1CC2CC[N+]1(C[C@@H]2[C@@H](C3=CC=NC4=CC=CC=C34)OCC=C)CC5=CC6=C(C=C5)C=CC(=C6)C[N+]78CCC(C[C@H]7[C@@H](C9=CC=NC1=CC=CC=C91)OCC=C)C(C8)CC.[Br-].[Br-]

Technology Process of 4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide

There total 10 articles about 4-[(R)-[(2S)-5-Ethyl-1-[[7-[[(5R)-2-ethyl-5-[(S)-prop-2-enoxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]methyl]naphthalen-2-yl]methyl]-1-azoniabicyclo[2.2.2]octan-2-yl]-prop-2-enoxymethyl]quinoline;dibromide 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: 96.0%

: 2,7-bis(hydrocinchonidinium-N-methyl)naphthalene dibromide

: 106-95-6
allyl bromide

: 480427-57-4
2,7-bis[9-O-allylhydrocinchonidinium-N-methyl]naphthalene dibromide

Guidance literature:: With potassium hydroxide; In water; for 0.25h;
DOI:10.1055/s-0028-1087809

Reference yield: 95.0%

: 2,7-bis(hydrocinchonidinium-N-methyl)naphthalene dibromide

: 106-95-6
allyl bromide

: 480427-57-4
2,7-bis[O(9)-allylhydrocinchonidinium-N-methyl]naphthalene dibromide

Guidance literature:: With potassium hydroxide; In dichloromethane; water; at 20 ℃; for 4h;
DOI:10.1016/j.tet.2007.05.076

Reference yield: 94.0%

: 2,7-bis(hydrocinchonidinium-N-methyl) naphthalene dibromide

: 106-95-6
allyl bromide

: 480427-57-4
2,7-bis[O(9)-allylhydrocinchonidinium-N-methyl]naphthalene dibromide

Guidance literature:: With potassium hydroxide; In dichloromethane; water; at 20 ℃; for 0.25h; Inert atmosphere;
DOI:10.1016/j.tetlet.2009.05.090