5-(Ethoxymethyl)quinolin-8-ol

Base Information

• Chemical Name: 5-(Ethoxymethyl)quinolin-8-ol
• CAS No.: 22049-19-0
• Molecular Formula: C₁₂H₁₃NO₂
• Molecular Weight: 203.241
• Hs Code.: 2933499090
• NSC Number: 130826
• DSSTox Substance ID: DTXSID80299450
• Nikkaji Number: J460.830E
• Wikidata: Q82041872
• ChEMBL ID: CHEMBL1566852
• Mol file: 22049-19-0.mol

Synonyms:5-(ethoxymethyl)quinolin-8-ol;22049-19-0;5-(ethoxymethyl)-8-quinolinol;AKOS AU36-M602;CHEMBL1566852;NSC130826;CBMicro_029900;Cambridge id 5734687;Oprea1_581304;Oprea1_870806;5-ethyloxymethyl-8-quinolinol;SCHEMBL14768490;DTXSID80299450;8-Quinolinol, 5-(ethoxymethyl)-;BDBM50490539;CCG-16979;MFCD01057783;STK860401;AKOS000658837;NSC-130826;SB71742;NCGC00161906-01;BS-37477;BIM-0029858.P001;CS-0151427;EU-0072230;D94920;SR-01000439393;SR-01000439393-1

Chemical Property of 5-(Ethoxymethyl)quinolin-8-ol

Chemical Property:

• Vapor Pressure: 1.01E-05mmHg at 25°C
• Boiling Point: 361.2°Cat760mmHg
• Flash Point: 172.2°C
• PSA: 42.35000
• Density: 1.189g/cm³
• LogP: 2.47690
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 203.094628657
• Heavy Atom Count: 15
• Complexity: 198

Purity/Quality:

98%min ^*data from raw suppliers

5-(ethoxymethyl)-8-quinolinol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOCC1=C2C=CC=NC2=C(C=C1)O

Technology Process of 5-(Ethoxymethyl)quinolin-8-ol

There total 6 articles about 5-(Ethoxymethyl)quinolin-8-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: 54.0%

ethanol (64-17-5) + 5-chloromethyl-8-hydroxyquinoline hydrochloride (4053-45-6) → 5-Ethoxymethyl-8-hydroxy-chinolin (22049-19-0)

Guidance literature:

ethanol; 5-chloromethyl-8-hydroxyquinoline hydrochloride; Reflux;

With ammonium hydroxide; In diethyl ether;

DOI:10.1016/j.molstruc.2016.11.090

Reference yield:

5-Ethoxymethyl-8-hydroxyquinolin-1-ium chloride → 5-Ethoxymethyl-8-hydroxy-chinolin (22049-19-0)

Guidance literature:

With ammonium hydroxide; In diethyl ether; water; pH=8 - 10;

DOI:10.1371/journal.pone.0129807

Reference yield:

8-quinolinol (148-24-3,24804-14-6) → 5-Ethoxymethyl-8-hydroxy-chinolin (22049-19-0)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogenchloride; zinc(II) chloride / water / 12 h

2: 2 h / 90 °C

3: ammonium hydroxide / water; diethyl ether / pH 8 - 10

With hydrogenchloride; ammonium hydroxide; zinc(II) chloride; In diethyl ether; water;

DOI:10.1371/journal.pone.0129807

upstream raw materials:

5-chloromethyl-8-hydroxyquinoline hydrochloride

8-quinolinol

ethanol

5-(chloromethyl)quinolin-8-ol