(5E)-5-{[4-(Dimethylamino)phenyl]imino}quinolin-8(5H)-one

Base Information

• Chemical Name: (5E)-5-{[4-(Dimethylamino)phenyl]imino}quinolin-8(5H)-one
• CAS No.: 111811-34-8
• Molecular Formula: C17H15 N3 O
• Molecular Weight: 277.32
• European Community (EC) Number: 631-202-2
• DSSTox Substance ID: DTXSID00404387
• Nikkaji Number: J1.040.952G
• Mol file: 111811-34-8.mol

Synonyms:111811-34-8;5-[4-(dimethylamino)phenyl]iminoquinolin-8-one;(5E)-5-{[4-(Dimethylamino)phenyl]imino}quinolin-8(5H)-one;5-((4-(Dimethylamino)phenyl)imino)quinolin-8(5H)-one;SCHEMBL14436926;DTXSID00404387;5-(4-dimethylamino-phenylimino)quinolin-8(5h)-one

Chemical Property of (5E)-5-{[4-(Dimethylamino)phenyl]imino}quinolin-8(5H)-one

Chemical Property:

• Melting Point: 147-148 °C(lit.)
• PSA: 45.56000
• LogP: 3.02090
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 277.121512110
• Heavy Atom Count: 21
• Complexity: 447

Purity/Quality:

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=C(C=C1)N=C2C=CC(=O)C3=C2C=CC=N3

Technology Process of (5E)-5-{[4-(Dimethylamino)phenyl]imino}quinolin-8(5H)-one

There total 1 articles about (5E)-5-{[4-(Dimethylamino)phenyl]imino}quinolin-8(5H)-one 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: 71.0%

8-quinolinol (148-24-3,24804-14-6) + N,N-dimethyl-p-phenylenediamine hydrochloride (2052-46-2,13806-04-7) → 5-(4'-dimethylaminophenylimino)quinolin-8-one (111811-34-8)

Guidance literature:

With ammonium peroxydisulfate; In water; at 5 ℃; for 0.166667h; NaOCl;

Reference yield: 91.0%

copper(II) perchlorate hexahydrate + 5-(4'-dimethylaminophenylimino)quinolin-8-one (111811-34-8) → bis{5-(4'-dimethylaminophenylimino)quinolin-8-one} copper(II) diperchlorate

Guidance literature:

In ethanol; water; The reaction takes place in ethanol-water under N2.;

Reference yield: 77.0%

5-(4'-dimethylaminophenylimino)quinolin-8-one (111811-34-8) → 5-(4-Dimethylamino-phenylamino)-quinolin-8-ol (131036-29-8)

Guidance literature:

With sodium dithionite; alkaline conditions;

DOI:10.1039/c39900001253

upstream raw materials:

8-quinolinol

N,N-dimethyl-p-phenylenediamine hydrochloride

Downstream raw materials:

5-(4-Dimethylamino-phenylamino)-quinolin-8-ol

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