6,7-Dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Base Information

Chemical Name:6,7-Dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline
CAS No.:96315-85-4
Molecular Formula:C17H18N2O4
Molecular Weight:314.341
Hs Code.:
DSSTox Substance ID:DTXSID801179597
Nikkaji Number:J2.276.185D
ChEMBL ID:CHEMBL54396

Synonyms:6,7-dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline;Oprea1_733335;CBDivE_010002;CHEMBL54396;DTXSID801179597;STK701179;AKOS001737472;1,2,3,4-Tetrahydro-6,7-dimethoxy-1-(3-nitrophenyl)isoquinoline;1-(3-Nitrophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;96315-85-4

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Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 6,7-Dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:314.12665706
Heavy Atom Count:23
Complexity:414

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C(C=C2C(NCCC2=C1)C3=CC(=CC=C3)[N+](=O)[O-])OC

Technology Process of 6,7-Dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

There total 5 articles about 6,7-Dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline 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: 80.0%

: 99-61-6
3-nitro-benzaldehyde

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

: 96315-85-4
6,7-dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Guidance literature:: With trifluoroacetic acid; for 2.5h; Heating;
DOI:10.1016/j.tet.2005.11.040

Reference yield:

: 1503-46-4
(3,4-dimethoxy-phenethyl)-(3-nitro-benzyliden)-amine

: 96315-85-4
6,7-dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Guidance literature:: (3,4-dimethoxy-phenethyl)-(3-nitro-benzyliden)-amine; With trifluoroacetic acid; at 90 ℃; for 0.0833333h; under 10343.2 Torr; Microwave irradiation;

With sodium hydroxide; In water;
DOI:10.1016/j.bmc.2009.03.066

Reference yield:

: 99-61-6
3-nitro-benzaldehyde

: 96315-85-4
6,7-dimethoxy-1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Guidance literature:: Multi-step reaction with 2 steps

1: toluene / 3 h / Heating

2: TFA / 90 h / Heating

With trifluoroacetic acid; In toluene;
DOI:10.1016/j.farmac.2003.10.003