6-Quinolinylmethanol

Base Information

• Chemical Name: 6-Quinolinylmethanol
• CAS No.: 100516-88-9
• Molecular Formula: C10H9NO
• Molecular Weight: 159.188
• Hs Code.: 29334900
• European Community (EC) Number: 600-106-2
• DSSTox Substance ID: DTXSID90363873
• Nikkaji Number: J550.328K
• Wikidata: Q72505949
• Mol file: 100516-88-9.mol

Synonyms:6-hydroxymethylquinoline;6-OH-Me, quinoline

Chemical Property of 6-Quinolinylmethanol

Chemical Property:

• Appearance/Colour: pink solid
• Vapor Pressure: 4.92E-05mmHg at 25°C
• Melting Point: 58-60 °C
• Refractive Index: 1.667
• Boiling Point: 334.8 °C at 760 mmHg
• PKA: 14.02±0.10(Predicted)
• Flash Point: 156.3 °C
• PSA: 33.12000
• Density: 1.218 g/cm³
• LogP: 1.72710
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 159.068413911
• Heavy Atom Count: 12
• Complexity: 149

Purity/Quality:

97% ^*data from raw suppliers

6-Quinolinylmethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 6-24/25-26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=CC(=C2)CO)N=C1

Technology Process of 6-Quinolinylmethanol

There total 11 articles about 6-Quinolinylmethanol 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: 94.0%

6-(methoxycarbonyl)quinoline (38896-30-9) → 6-(hydroxymethyl)quinoline (100516-88-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at -20 ℃; for 1h;

DOI:10.1021/acs.jmedchem.9b01492

Reference yield: 93.0%

quinoline-6-carboxylic acid ethyl ester (73987-38-9) → 6-(hydroxymethyl)quinoline (100516-88-9)

Guidance literature:

Reference yield: 83.6%

potassium (acetoxymethyl)trifluoroborate + quinolin-6-yl triflate (173089-80-0) → 6-(hydroxymethyl)quinoline (100516-88-9)

Guidance literature:

With sodium carbonate; bis(dibenzylideneacetone)-palladium⁽⁰⁾; ruphos; In 1,4-dioxane; water; for 24h; Inert atmosphere; Reflux;

DOI:10.1021/ol300149b

upstream raw materials:

quinoline-6-carbaldehyde

quinoline-6-carboxylic acid ethyl ester

2-Methyl-benzoic acid quinolin-6-ylmethyl ester

6-(methoxycarbonyl)quinoline

Downstream raw materials:

quinoline-6-carbaldehyde

6-[(phenylsulfanyl)methyl]quinoline

6-((6-bromo-1H-[1,2,3]triazolo[4,5-b]pyrazine-1-yl)methyl)quinoline

quinolin-6-ylmethanamine