3,8-Dimethyl-4,7-phenanthroline

Base Information

• Chemical Name: 3,8-Dimethyl-4,7-phenanthroline
• CAS No.: 36749-63-0
• Molecular Formula: C14H12N2
• Molecular Weight: 208.263
• DSSTox Substance ID: DTXSID70354486
• Wikidata: Q82132662
• Mol file: 36749-63-0.mol

Synonyms:3,8-dimethyl-4,7-phenanthroline;36749-63-0;Cambridge id 5567669;Oprea1_286156;SCHEMBL8571925;DTXSID70354486;AKOS024464783;SS-2495;SR-01000213756;SR-01000213756-1

Chemical Property of 3,8-Dimethyl-4,7-phenanthroline

Chemical Property:

• PSA: 25.78000
• LogP: 3.39980
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 208.100048391
• Heavy Atom Count: 16
• Complexity: 227

Purity/Quality:

99% ^*data from raw suppliers

3,8-Dimethyl-4,7-phenanthroline >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=C(C=C1)C3=C(C=C2)N=C(C=C3)C

Technology Process of 3,8-Dimethyl-4,7-phenanthroline

There total 4 articles about 3,8-Dimethyl-4,7-phenanthroline 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: 40.0%

1,4-phenylenediamine (106-50-3) + crotonaldehyde (123-73-9,4170-30-3) → 2,7-dimethyl-1,8-diazaphenanthrene (36749-63-0)

Guidance literature:

With sulfuric acid; 3-Nitrobenzenesulfonic acid; In acetic acid; at 160 - 165 ℃; for 20h;

Reference yield: 23.0%

para-dinitrobenzene (100-25-4) + ethanol (64-17-5) → 2,7-dimethyl-1,8-diazaphenanthrene (36749-63-0)

Guidance literature:

With oxygen-implanted molybdenum disulfide nanosheets; air; at 180 ℃; for 4h; under 3040.2 Torr;

DOI:10.1039/d1gc04058h

Reference yield:

2-methylquinolin-6-amine (65079-19-8) + crotonaldehyde (123-73-9,4170-30-3) → 2,7-dimethyl-1,8-diazaphenanthrene (36749-63-0)

Guidance literature:

With hydrogenchloride; sodium hydroxide; arsenic(V) oxide; Yield given. Multistep reaction; 1.) 90 deg C, 1 h, 2.) H₂O, pH 12;

DOI:10.1002/prac.19933350708

upstream raw materials:

1,4-phenylenediamine

crotonaldehyde

2-methylquinolin-6-amine

para-dinitrobenzene