(2-Methylquinolin-4-yl)methanol

Base Information

• Chemical Name: (2-Methylquinolin-4-yl)methanol
• CAS No.: 4939-28-0
• Molecular Formula: C19H20N2OS2
• Molecular Weight: 173.214
• Hs Code.: 2933499090
• DSSTox Substance ID: DTXSID00436148
• Wikidata: Q82251374
• Mol file: 4939-28-0.mol

Synonyms:(2-methylquinolin-4-yl)methanol;4939-28-0;(2-METHYL-QUINOLIN-4-YL)-METHANOL;MFCD07371472;(2-methyl-4-quinolinyl)methanol;2-methyl-4-hydroxymethylquinoline;2-methylquinolin-4-ylmethanol;SCHEMBL1366357;2-methyl4-hydroxymethylquinoline;DTXSID00436148;MNDWQNXETQDJMZ-UHFFFAOYSA-N;4-hydroxymethyl-2-methyl quinoline;AKOS009358708;SB37343;AS-61295;CS-0116687;FT-0694121;EN300-54949;(2-methyl-quinolin-4-yl)-methanol, AldrichCPR;A827708;J-500878;Z397587554

Chemical Property of (2-Methylquinolin-4-yl)methanol

Chemical Property:

• Vapor Pressure: 5.67E-15mmHg at 25°C
• Boiling Point: 594.4°Cat760mmHg
• Flash Point: 313.3°C
• PSA: 66.84000
• Density: 1.31g/cm³
• LogP: 2.89250
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 173.084063974
• Heavy Atom Count: 13
• Complexity: 172

Purity/Quality:

97% ^*data from raw suppliers

(2-Methylquinolin-4-yl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=CC=CC=C2C(=C1)CO

Technology Process of (2-Methylquinolin-4-yl)methanol

There total 9 articles about (2-Methylquinolin-4-yl)methanol 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: 93.0%

methanol (67-56-1) + 2-methylquinoline (91-63-4) → 4-(hydroxymethyl)-2-methylquinoline (4939-28-0)

Guidance literature:

With silver nitrate; Selectfluor; In water; at 80 ℃; for 4h; Time; Temperature; Sealed tube;

DOI:10.1039/c9ra09954a

Reference yield: 88.2%

methyl 2-methylquinoline-4-carboxylate (55625-40-6) → 4-(hydroxymethyl)-2-methylquinoline (4939-28-0)

Guidance literature:

With methanol; sodium tetrahydroborate; at 20 ℃; for 24h; Cooling with ice;

Reference yield: 63.5%

ethyl 2-methylquinoline-4-carboxylate (7120-26-5) → 4-(hydroxymethyl)-2-methylquinoline (4939-28-0)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 - 20 ℃; for 4h;

DOI:10.1021/acs.jmedchem.8b01755

upstream raw materials:

methyl 2-methylquinoline-4-carboxylate

methanol

2-methylquinoline

ethylene glycol

Downstream raw materials:

2-[4-(2-methyl-quinolin-4-ylmethoxy)-phenyl]-1,1-dioxo-1λ⁶-isothiazolidine-3-carboxylic acid methyl ester

2-[4-(2-methyl-quinolin-4-ylmethoxy)-benzyl]-1,1-dioxo-tetrahydro-1λ⁶-thiophene-3-carboxylic acid methyl ester

2-[4-(2-methyl-quinolin-4-ylmethoxy)-phenyl]-1,1-dioxo-1λ⁶-[1,2]thiazinane-3-carboxylic acid methyl ester

2-[4-(2-methyl-quinolin-4-ylmethoxy)-benzyl]-1,1-dioxo-1λ⁶-isothiazolidine-3-carboxylic acid methyl ester