1-Ethylquinolinium iodide

Base Information

• Chemical Name: 1-Ethylquinolinium iodide
• CAS No.: 634-35-5
• Deprecated CAS: 32797-04-9,792922-69-1
• Molecular Formula: C11H12 N . I
• Molecular Weight: 285.127
• European Community (EC) Number: 211-206-7
• DSSTox Substance ID: DTXSID40883516
• Mol file: 634-35-5.mol

Synonyms:1-Ethylquinolinium iodide;634-35-5;Quinoline ethiodide;1-ethylquinolin-1-ium iodide;N-Ethylquinolinium iodide;1-ethylquinolin-1-ium;iodide;Quinolinium, 1-ethyl-, iodide;NSC 436;EINECS 211-206-7;Quinolinium, 1-ethyl-, iodide (1:1);AI3-15408;C11H12N.I;SCHEMBL186988;1-Ethylquinolinium iodide, 98%;DTXSID40883516;C11-H12-N.I;MFCD00041996;AKOS003368178;LS-142357;CS-0128422;E0173;FT-0632689;EN300-18437;D81711

Chemical Property of 1-Ethylquinolinium iodide

Chemical Property:

• Melting Point: 158-160°C
• PSA: 3.88000
• LogP: -0.84880
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Sensitive.: Hygroscopic
• Water Solubility.: almost transparency
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 285.00145
• Heavy Atom Count: 13
• Complexity: 144

Purity/Quality:

98%,99%, ^*data from raw suppliers

Quinoline Ethiodide >99.0%(T) ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Quinolines
• Canonical SMILES: CC[N+]1=CC=CC2=CC=CC=C21.[I-]

Technology Process of 1-Ethylquinolinium iodide

There total 2 articles about 1-Ethylquinolinium iodide 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: 68.0%

quinoline (91-22-5) + ethyl iodide (75-03-6) → N-ethylquinolinium iodide (634-35-5)

Guidance literature:

In acetonitrile; at 80 ℃; for 16h;

DOI:10.1021/acs.joc.0c02321

Reference yield:

→ N-ethylquinolinium iodide (634-35-5)

Guidance literature:

Chinolin (1), 1. Chinoliniumbetain (13) 2. H2O;

Reference yield: 92.0%

o-fluorophenylboronic acid (1993-03-9) + N-ethylquinolinium iodide (634-35-5) → (R)-1-ethyl-2-(2-fluorophenyl)-1,2-dihydroquinoline

Guidance literature:

With silver tetrafluoroborate; chloro(1,5-cyclooctadiene)rhodium(I) dimer; potassium phosphate tribasic trihydrate; (R)-2,2'-bis(diphenylphosphanyl)-1,1'-binaphthyl; In toluene; at 45 ℃; for 12h; enantioselective reaction; Inert atmosphere;

DOI:10.1002/anie.201511663

upstream raw materials:

quinoline

ethyl iodide

Downstream raw materials:

3-ethyl-5-(1-ethyl-1H-quinolin-4-ylidene)-2-thioxo-thiazolidin-4-one

1,1'-diethyl-2,4-cyanine iodide

(1-ethyl-[4]quinolyl)-(1-phenyl-[4]quinolyl)-methinium ; iodide

1-Ethyl-4-<3-methyl-2,3-dihydro-benzothiazolyliden-(2)-methyl>-chinolinium-iodid

Refernces

• 1、 Jafari, Behzad,Khodabakhshi, Mohammad Reza,Kiamehr, Mostafa,Langer, Peter,Mohammadkhani, Leyla. "Synthesis of Tetrahydropyrazolo[4',3':5,6]pyrano[3,4- c ]quinolones by Domino Knoevenagel/Hetero Diels-Alder Reactions". . p. 1782 - 1786. Retrieved 2019/09/09.
• 2、 Ghandi, Mehdi,Kia, Maryam Asle,Sadeghzadegh, Masoud,Bozcheloei, Abolfazl Hasani,Kubicki, Maciej. "Diastereoselective Synthesis of Novel Pyrrolidine or Pyrrolizine-Fused Benzo-δ-sultams via 1,3-Dipolar Cycloadditions". . p. 1646 - 1653. Retrieved 2015/02/19.