8-Methylquinoline

Base Information

• Chemical Name: 8-Methylquinoline
• CAS No.: 611-32-5
• Molecular Formula: C10H9N
• Molecular Weight: 143.188
• Hs Code.: 29334900
• European Community (EC) Number: 210-264-0
• NSC Number: 9409
• UNII: K97B12J636
• DSSTox Substance ID: DTXSID8020888
• Nikkaji Number: J841I
• Wikidata: Q27121420
• Metabolomics Workbench ID: 57151
• ChEMBL ID: CHEMBL1702610
• Mol file: 611-32-5.mol

Synonyms:8-methylquinoline

Chemical Property of 8-Methylquinoline

Chemical Property:

• Appearance/Colour: clear yellow liquid
• Vapor Pressure: 0.04mmHg at 25°C
• Melting Point: -80 °C
• Refractive Index: n20/D 1.614(lit.)
• Boiling Point: 247.499 °C at 760 mmHg
• PKA: 5.03±0.17(Predicted)
• Flash Point: 105 °C
• PSA: 12.89000
• Density: 1.076 g/cm³
• LogP: 2.54320
• Storage Temp.: Room Temperature
• Solubility.: Chloroform, Methanol
• Water Solubility.: 0.1-0.5 g/100 mL at 17 ºC
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 143.073499291
• Heavy Atom Count: 11
• Complexity: 133

Purity/Quality:

99% ^*data from raw suppliers

8-Methylquinoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-68-22
• Safety Statements: 26-36-45-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=C2C(=CC=C1)C=CC=N2
• Uses: 8-Methylquinoline has been used in preparation of osmium chloridophosphine complexes, as quinoline carbene tautomers.Tumorigenic potential of 8-methylquinoline has been evaluated in newborn CD-1 mice and Sprague-Dawley rats. 8-Methylquinoline has been used in preparation of osmium chloridophosphine complexes, as quinoline carbene tautomers. 8-Methylquinoline is used in QSAR treatment of mutagenicity and cytotoxicity of quinolines.

Technology Process of 8-Methylquinoline

There total 38 articles about 8-Methylquinoline 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%

8-methyl-1,2,3,4-tetrahydroquinoline (52601-70-4) → 8-methylquinoline (611-32-5)

Guidance literature:

With diethylazodicarboxylate; In chloroform; toluene; at 20 ℃; for 12h;

DOI:10.1080/00397911.2018.1445866

Reference yield: 93.0%

→ 8-methylquinoline (611-32-5)

Guidance literature:

With diethylazodicarboxylate; In chloroform; toluene; at 20 ℃; for 12h;

Reference yield: 92.0%

o-toluidine (95-53-4) + trimethyleneglycol (504-63-2) → 8-methylquinoline (611-32-5)

Guidance literature:

With tetrachloromethane; iron(III) chloride hexahydrate; at 150 ℃; for 8h; Inert atmosphere; Sealed tube;

DOI:10.1134/S1070363215120105

upstream raw materials:

8-methyl-1,2,3,4-tetrahydroquinoline

mercury(II) diacetate

glycerol

o-toluidine

Downstream raw materials:

4-cyano-8-methylquinoline

2-(4-chloro-phenyl)-8-methyl-quinoline

(2-(4-methoxyphenyl)-8-methylquinoline)

1,8-dimethylquinolin-1-ium iodide

Refernces

• 1、 Quan, Yangjian,Lan, Guangxu,Shi, Wenjie,Xu, Ziwan,Fan, Yingjie,You, Eric,Jiang, Xiaomin,Wang, Cheng,Lin, Wenbin. "Metal–Organic Layers Hierarchically Integrate Three Synergistic Active Sites for Tandem Catalysis". supporting information. p. 3115 - 3120. Retrieved 2020/12/09.
• 2、 Manna, Srimanta,Kong, Wei-Jun,B?ckvall, Jan-E.. "Iron(II)-Catalyzed Aerobic Biomimetic Oxidation of N-Heterocycles". supporting information. p. 13725 - 13729. Retrieved 2021/09/08.