3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate

Base Information

Chemical Name:3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate
CAS No.:86362-36-9
Molecular Formula:C35H53 N O3
Molecular Weight:535.811
Hs Code.:
European Community (EC) Number:289-227-6
DSSTox Substance ID:DTXSID40860600
Nikkaji Number:J333.950E
Mol file:86362-36-9.mol

Synonyms:86362-36-9;EINECS 289-227-6;3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate;[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] pyridine-3-carboxylate;Juvela nicotinate;3-Pyridinecarboxylic acid,(2R)-3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-yl ester, rel-;Hijuven;()--Tocopherol nicotinate;SCHEMBL73877;DTXSID40860600;BCP13683;MFCD03548047;AKOS015963784;Tocopherol nicotinate;Tocopherolnicotinate;FT-0622206;FT-0625432;FT-0653083;A810768;A924247;[2R-2R*(4R*,8R*)]-3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol nicotinate;2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl pyridine-3-carboxylate;2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl nicotinate #;3-pyridinecarboxylic acid [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl] ester;3-Pyridinecarboxylic acid [3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran]-6-yl ester

Suppliers and Price of 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate

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

Total 5 raw suppliers

Chemical Property of 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate

Chemical Property:

Vapor Pressure:0-0Pa at 20-50℃
Boiling Point:395℃ at 101.3kPa
PSA：48.42000
Density:0.97 at 50℃
LogP:9.74880
XLogP3:11.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:15
Exact Mass:535.40254455
Heavy Atom Count:39
Complexity:725

Purity/Quality:: 99.9% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C3=CN=CC=C3)C

Technology Process of 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate

There total 4 articles about 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate 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: 75.0%

: 59-67-6
nicotinic acid

: 59-02-9,18920-62-2
vitamin E

: 86362-36-9,16676-75-8,51898-34-1
DL-α-tocopherol nicotinate

Guidance literature:: With N,N-bis[2-oxo-3-oxazolidinyl]phosphorodiamidic chloride; triethylamine; In dichloromethane; for 1.5h;

Reference yield:

: 10400-19-8
3-pyridinecarbonyl chloride

: 59-02-9,18920-62-2
vitamin E

: 86362-36-9,16676-75-8,51898-34-1
DL-α-tocopherol nicotinate

Guidance literature:: With dmap; In tetrahydrofuran; at 75 ℃; for 2h;
DOI:10.1081/SCC-120022178

Reference yield:

: 59-67-6
nicotinic acid

: 86362-36-9,16676-75-8,51898-34-1
DL-α-tocopherol nicotinate

Guidance literature:: Multi-step reaction with 2 steps

1: triphenylphosphine; trichloroacetonitrile / tetrahydrofuran / 3 h / 20 °C

2: 900 mg / 4-(dimethylamino)pyridine / tetrahydrofuran / 2 h / 75 °C

With dmap; trichloroacetonitrile; triphenylphosphine; In tetrahydrofuran;
DOI:10.1081/SCC-120022178