Benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

Base Information

Chemical Name:Benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate
CAS No.:787640-41-9
Molecular Formula:C₁₇H₁₈N₂O₂
Molecular Weight:282.342
Hs Code.:
DSSTox Substance ID:DTXSID801177115

Synonyms:787640-41-9;BENZYL 7-AMINO-3,4-DIHYDROISOQUINOLINE-2(1H)-CARBOXYLATE;SCHEMBL325572;GPZJQDPDHQAGOI-UHFFFAOYSA-N;DTXSID801177115;FT-0749268;A1-48651;Phenylmethyl 7-amino-3,4-dihydro-2(1H)-isoquinolinecarboxylate;7-Amino-3,4-dihydro-1H-isoquinoline-2-carboxylic acid benzyl ester

Suppliers and Price of Benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

Supply Marketing:

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

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Chemical Property of Benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:282.136827821
Heavy Atom Count:21
Complexity:355

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CC2=C1C=CC(=C2)N)C(=O)OCC3=CC=CC=C3

Technology Process of Benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

There total 8 articles about Benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate 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: 100.0%

: 72299-68-4
1,2,3,4-Tetrahydro-isoquinolin-7-ylamine

: 501-53-1,94274-21-2
benzyl chloroformate

: 787640-41-9
benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

Guidance literature:: With triethylamine; In tetrahydrofuran; at 20 ℃; for 4h;

Reference yield: 71.0%

: benzyl 7-nitro-3,4-dihydroisoquinoline-2(1H)-carboxylate

: 787640-41-9
benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

Guidance literature:: With tin(ll) chloride; In ethanol; at 85 ℃;
DOI:10.1016/j.bmcl.2007.07.051

Reference yield:

: 91-21-4
1,2,3,4-tetrahydroisoquinoline

: 787640-41-9
benzyl 7-amino-3,4-dihydroisoquinoline-2(1H)-carboxylate

Guidance literature:: Multi-step reaction with 3 steps

1.1: sulfuric acid; potassium nitrate / 0 - 20 °C

1.2: 0 °C

1.3: 0.08 h

2.1: water; sodium hydrogencarbonate / dichloromethane / 0.67 h

2.2: 3 h

3.1: triethylamine / dichloromethane / 3 h / 20 °C

With sulfuric acid; water; sodium hydrogencarbonate; potassium nitrate; triethylamine; In dichloromethane;