2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-imidazo(2,1-a)isoquinolin-5-ol

Base Information

Chemical Name:2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-imidazo(2,1-a)isoquinolin-5-ol
CAS No.:56882-44-1
Molecular Formula:C₁₈H₁₅F₃N₂O
Molecular Weight:332.325
Hs Code.:
DSSTox Substance ID:DTXSID20972311
Nikkaji Number:J61.484J
ChEMBL ID:CHEMBL352132

Synonyms:BRN 0706110;56882-44-1;2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-imidazo(2,1-a)isoquinolin-5-ol;Imidazo(2,1-a)isoquinolin-5-ol, 2,3,5,6-tetrahydro-5-(3-(trifluoromethyl)phenyl)-;Imidazo(2,1-a)isoquinolin-5-ol, 2,3,5,6-tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-;CHEMBL352132;SCHEMBL9693710;C18H15F3N2O;DTXSID20972311;YFHNWKNJTLUVAM-UHFFFAOYSA-N;C18-H15-F3-N2-O;LS-77921;2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)imidazo[2,1-a]isoquinolin-5-ol;5-[3-(Trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinolin-5-ol

Suppliers and Price of 2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-imidazo(2,1-a)isoquinolin-5-ol

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 3 raw suppliers

Chemical Property of 2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-imidazo(2,1-a)isoquinolin-5-ol

Chemical Property:

Vapor Pressure:6.54E-08mmHg at 25°C
Boiling Point:423°C at 760 mmHg
Flash Point:209.6°C
PSA：35.83000
Density:1.38g/cm³
LogP:2.54250
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:332.11364759
Heavy Atom Count:24
Complexity:521

Purity/Quality:: 99% ^*data from raw 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)C(F)(F)F)O

Technology Process of 2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-imidazo(2,1-a)isoquinolin-5-ol

There total 4 articles about 2,3,5,6-Tetrahydro-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-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:

: 454-92-2
3-(trifluoromethyl)benzoic acid

: 56882-44-1
5-(m-trifluoromethylphenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinoline-5-ol

Guidance literature:: Multi-step reaction with 3 steps

1: SOCl₂ / CH₂Cl₂ / 5 h / Heating

2: benzene; methanol / Ambient temperature

3: 1.) n-BuLi / 1.) THF, hexane, 35 deg C, 4 h, 2.) THF, hexane, -20 deg C, 3 h

With n-butyllithium; thionyl chloride; In methanol; dichloromethane; benzene;
DOI:10.1021/jm00359a025

Reference yield:

: 2251-65-2
3-(Trifluoromethyl)benzoyl chloride

: 56882-44-1
5-(m-trifluoromethylphenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinoline-5-ol

Guidance literature:: Multi-step reaction with 2 steps

1: benzene; methanol / Ambient temperature

2: 1.) n-BuLi / 1.) THF, hexane, 35 deg C, 4 h, 2.) THF, hexane, -20 deg C, 3 h

With n-butyllithium; In methanol; benzene;
DOI:10.1021/jm00359a025

Reference yield:

: 2557-13-3
3-trifluoromethylbenzoic acid methyl ester

: 57327-93-2
2-(o-Tolyl)-2-imidazoline

: 56882-44-1
5-(m-trifluoromethylphenyl)-2,3,5,6-tetrahydroimidazo[2,1-a]isoquinoline-5-ol

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