2,6-Dichloroquinoline-3-methanol

Base Information

• Chemical Name: 2,6-Dichloroquinoline-3-methanol
• CAS No.: 1017429-35-4
• Molecular Formula: C₁₀H₇Cl₂NO
• Molecular Weight: 228.078
• Hs Code.: 2933499090
• European Community (EC) Number: 802-653-4
• DSSTox Substance ID: DTXSID30443441
• Wikidata: Q82261263
• Mol file: 1017429-35-4.mol

Synonyms:2,6-Dichloroquinoline-3-methanol;1017429-35-4;(2,6-dichloroquinolin-3-yl)methanol;DTXSID30443441;MFCD09997988;FT-0758641;2,6-Dichloroquinoline-3-methanol, AldrichCPR

Chemical Property of 2,6-Dichloroquinoline-3-methanol

Chemical Property:

• PSA: 33.12000
• LogP: 3.03390
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 226.9904692
• Heavy Atom Count: 14
• Complexity: 203

Purity/Quality:

97% ^*data from raw suppliers

2,6-Dichloroquinoline-3-methanol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=NC(=C(C=C2C=C1Cl)CO)Cl

Technology Process of 2,6-Dichloroquinoline-3-methanol

There total 1 articles about 2,6-Dichloroquinoline-3-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:

2,6-dichloroquinoline-3-carbaldehyde (73568-41-9) → (2,6-dichloro-quinolin-3-yl)-methanol (1017429-35-4)

Guidance literature:

With sodium tetrahydroborate; In methanol; for 0.5h; Ambient temperature;

DOI:10.1021/jm980400l

Reference yield: 90.0%

(2,6-dichloro-quinolin-3-yl)-methanol (1017429-35-4) → 2,6-Dichloro-3-chloromethyl-quinoline (948290-83-3)

Guidance literature:

With thionyl chloride; In dichloromethane; N,N-dimethyl-formamide; Reflux;

DOI:10.1039/c5nj02566d

Reference yield:

(2,6-dichloro-quinolin-3-yl)-methanol (1017429-35-4) → N-((2,6-dichloroquinolin-3-yl)methyl)-N-phenyl-5-(pyridin-4-yl)-1,3,4-oxadiazol-2-amine

Guidance literature:

Multi-step reaction with 2 steps

1: thionyl chloride / dichloromethane; N,N-dimethyl-formamide / Reflux

2: potassium carbonate / N,N-dimethyl-formamide / 80 - 90 °C

With thionyl chloride; potassium carbonate; In dichloromethane; N,N-dimethyl-formamide;

DOI:10.1039/c5nj02566d

upstream raw materials:

2,6-dichloroquinoline-3-carbaldehyde

Downstream raw materials:

2,6-Dichloro-3-chloromethyl-quinoline