Isoquinoline, 1-amino-3-tert-butyl-

Base Information

Chemical Name:Isoquinoline, 1-amino-3-tert-butyl-
CAS No.:58814-41-8
Molecular Formula:C13H16N2
Molecular Weight:200.2795
Hs Code.:
DSSTox Substance ID:DTXSID30207545
Wikidata:Q83081447

Synonyms:Isoquinoline, 1-amino-3-tert-butyl-;BRN 0474703;1-Amino-3-tert-butylisoquinoline;58814-41-8;1-Isoquinolinamine, 3-(1,1-dimethylethyl)-;5-22-10-00433 (Beilstein Handbook Reference);3-tert-butylisoquinolin-1-amine;SCHEMBL1370441;DTXSID30207545;AKOS005232368;LS-85351

Suppliers and Price of Isoquinoline, 1-amino-3-tert-butyl-

Supply Marketing:

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

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of Isoquinoline, 1-amino-3-tert-butyl-

Chemical Property:

Vapor Pressure:8.18E-05mmHg at 25°C
Boiling Point:341.2°Cat760mmHg
Flash Point:186.9°C
Density:1.078g/cm³
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:200.131348519
Heavy Atom Count:15
Complexity:219

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CC2=CC=CC=C2C(=N1)N

Technology Process of Isoquinoline, 1-amino-3-tert-butyl-

There total 3 articles about Isoquinoline, 1-amino-3-tert-butyl- 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: 78.0%

: 1425605-46-4
2-(3,3-dimethylbut-1-yn-1-yl)benzamide

: 58814-41-8
3-(tert-Butyl)isoquinolin-1-amine

Guidance literature:: With silver hexafluoroantimonate; ammonium acetate; In acetonitrile; at 85 ℃; for 24h; Schlenk technique; Inert atmosphere;
DOI:10.1177/1747519820924736

Reference yield:

: 917-92-0
3,3-Dimethylbut-1-yne

: 4001-73-4
2-Bromobenzamide

: 58814-41-8
3-(tert-Butyl)isoquinolin-1-amine

Guidance literature:: Multi-step reaction with 2 steps

1: bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine / N,N-dimethyl-formamide / 3 h / 120 °C / Microwave irradiation; Inert atmosphere

2: ammonium acetate; sodium tetrachloroaurate(III) dihydrate; silver hexafluoroantimonate / acetonitrile / 20 h / 85 °C

With bis-triphenylphosphine-palladium(II) chloride; silver hexafluoroantimonate; copper(l) iodide; sodium tetrachloroaurate(III) dihydrate; ammonium acetate; triethylamine; In N,N-dimethyl-formamide; acetonitrile; 1: |Sonogashira Cross-Coupling;
DOI:10.1021/jo302794z