2,3,5,6-Tetrahydro-5-phenyl-imidazo(2,1-a)isoquinolin-5-ol

Base Information

• Chemical Name: 2,3,5,6-Tetrahydro-5-phenyl-imidazo(2,1-a)isoquinolin-5-ol
• CAS No.: 56882-45-2
• Molecular Formula: C₁₇H₁₆N₂O
• Molecular Weight: 264.327
• DSSTox Substance ID: DTXSID80972312
• Nikkaji Number: J61.479C
• ChEMBL ID: CHEMBL424184

Synonyms:BRN 0668461;56882-45-2;2,3,5,6-Tetrahydro-5-phenyl-imidazo(2,1-a)isoquinolin-5-ol;Imidazo(2,1-a)isoquinolin-5-ol, 2,3,5,6-tetrahydro-5-phenyl-;2,3,5,6-Tetrahydro-5-phenylimidazo[2,1-a]isoquinolin-5-ol;CHEMBL424184;SCHEMBL9693424;DTXSID80972312;LS-77916;5-Phenyl-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-5-ol

Chemical Property of 2,3,5,6-Tetrahydro-5-phenyl-imidazo(2,1-a)isoquinolin-5-ol

Chemical Property:

• Vapor Pressure: 1.45E-08mmHg at 25°C
• Boiling Point: 441.3°Cat760mmHg
• Flash Point: 220.7°C
• PSA: 35.83000
• Density: 1.25g/cm³
• LogP: 1.52370
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 264.126263138
• Heavy Atom Count: 20
• Complexity: 402

Purity/Quality:

99% ^*data from raw suppliers

2,3,5,6-TETRAHYDRO-5-PHENYLIMIDAZO[2,1-A]ISOQUINOLIN-5-OL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN2C(=N1)C3=CC=CC=C3CC2(C4=CC=CC=C4)O

Technology Process of 2,3,5,6-Tetrahydro-5-phenyl-imidazo(2,1-a)isoquinolin-5-ol

There total 3 articles about 2,3,5,6-Tetrahydro-5-phenyl-imidazo(2,1-a)isoquinolin-5-ol 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:

benzoic acid methyl ester (93-58-3,5705-52-2,80226-58-0) + 2-(o-Tolyl)-2-imidazoline (57327-93-2) → 5-phenyl-2,3,5,6-tetrahydroimidazo<2,1-a>isoquinolin-5-ol (56882-45-2)

Guidance literature:

With n-butyllithium; Yield given. Multistep reaction; 1.) THF, hexane, 35 deg C, 4 h, 2.) THF, hexane, -20 deg C, 3 h;

DOI:10.1021/jm00359a025

Reference yield:

(E)-3-(N,N-dimethylamino)-1-phenyl-2-propen-1-one (1131-80-2,1201-93-0,31919-75-2) + 2-(o-Tolyl)-2-imidazoline (57327-93-2) → 5-phenyl-2,3,5,6-tetrahydroimidazo<2,1-a>isoquinolin-5-ol (56882-45-2)

Guidance literature:

With n-butyllithium; Yield given. Multistep reaction; 1.) THF, hexane, 35 deg C, 4 h, 2.) -20 deg C, 3 h;

DOI:10.1021/jo00147a027

Reference yield:

→ 5-phenyl-2,3,5,6-tetrahydroimidazo<2,1-a>isoquinolin-5-ol (56882-45-2)

Guidance literature:

2-o-Tolyl-Δ²-imidazolin, Butyllithium, Benzoesaeure-aethylester;

upstream raw materials:

benzoic acid methyl ester

2-(o-Tolyl)-2-imidazoline

(E)-3-(N,N-dimethylamino)-1-phenyl-2-propen-1-one

Downstream raw materials:

5-phenyl-2,3-dihydroimidazo[2,1-a]isoquinoline

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