Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxyphenyl)methyl)-2-methyl-

Base Information

Chemical Name:Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxyphenyl)methyl)-2-methyl-
CAS No.:13425-06-4
Molecular Formula:C₂₀H₂₅NO₃
Molecular Weight:327.423
Hs Code.:
NSC Number:89826
DSSTox Substance ID:DTXSID60928534
Nikkaji Number:J407.029A
Wikidata:Q82903335
Metabolomics Workbench ID:44348
ChEMBL ID:CHEMBL452500
Mol file:13425-06-4.mol

Synonyms:CSH 068;CSH-068;CSH068

Suppliers and Price of Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxyphenyl)methyl)-2-methyl-

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
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price

Total 1 raw suppliers

Chemical Property of Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxyphenyl)methyl)-2-methyl-

Chemical Property:

Vapor Pressure:3.87E-08mmHg at 25°C
Boiling Point:445.7°Cat760mmHg
Flash Point:126.9°C
PSA：30.93000
Density:1.1g/cm³
LogP:3.42200
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:327.18344366
Heavy Atom Count:24
Complexity:383

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC)OC

Technology Process of Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxyphenyl)methyl)-2-methyl-

There total 86 articles about Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxyphenyl)methyl)-2-methyl- 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%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 41498-37-7
7,12-O,O'-dimethylcoclaurine

: 1934-93-6,13425-06-4
6,7-dimethoxy-1-(4-methoxybenzyl)-2-methyl-1,2,3,4-tetrahydroisoquinoline

Guidance literature:: formaldehyd; 7,12-O,O'-dimethylcoclaurine; In methanol; for 2h;

With sodium tetrahydroborate; In methanol; for 5h;
DOI:10.1071/ch00023

Reference yield: 90.0%

: 51714-24-0
6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile

: 2746-25-0
p-Methoxybenzyl bromide

: 1934-93-6,13425-06-4
6,7-dimethoxy-1-(4-methoxybenzyl)-2-methyl-1,2,3,4-tetrahydroisoquinoline

Guidance literature:: 6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile; With potassium hexamethylsilazane; In tetrahydrofuran; at 0 ℃; for 0.166667h; Inert atmosphere;

p-Methoxybenzyl bromide; In tetrahydrofuran; at 0 - 20 ℃; for 5h; Inert atmosphere;

With sodium cyanoborohydride; acetic acid; In tetrahydrofuran; ethanol; at 20 ℃; for 15h; Inert atmosphere;
DOI:10.1021/acs.orglett.7b00652

Reference yield: 78.0%

: 60383-76-8
(R)-1-(4'-methoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

: 4525-33-1
dimethyl dicarbonate

: 5701-00-8,13425-06-4
(R)-O-methylarmepavine

Guidance literature:: (R)-1-(4'-methoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline; dimethyl dicarbonate; In dichloromethane; at 20 ℃; for 0.333333h;

With lithium aluminium tetrahydride; In diethyl ether; at 0 ℃; for 0.333333h; Further stages.;
DOI:10.1021/jo001397s