Benz[a]acridine

Base Information

• Chemical Name: Benz[a]acridine
• CAS No.: 225-11-6
• Molecular Formula: C17H11 N
• Molecular Weight: 229.281
• Hs Code.: 2933990090
• European Community (EC) Number: 205-929-7
• UNII: D4Q8MR98LU
• DSSTox Substance ID: DTXSID9075371
• Nikkaji Number: J38.204C
• Wikidata: Q27155920
• Mol file: 225-11-6.mol

Synonyms:benz(a)acridine

Chemical Property of Benz[a]acridine

Chemical Property:

• Vapor Pressure: 9.76E-08mmHg at 25°C
• Melting Point: 131 °C
• Refractive Index: 1.783
• Boiling Point: 446.2 °C at 760 mmHg
• PKA: 4.71±0.25(Predicted)
• Flash Point: 201.4 °C
• PSA: 12.89000
• Density: 1.239 g/cm³
• LogP: 4.54120
• Storage Temp.: 2-8°C
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 229.089149355
• Heavy Atom Count: 18
• Complexity: 300

Purity/Quality:

99% ^*data from raw suppliers

Benz[a]acridine BCR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4C=C32

Technology Process of Benz[a]acridine

There total 49 articles about Benz[a]acridine 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: 74.0%

benzo[a]acridin-12-yl(phenyl)methanone → benz[a]acridine (225-11-6)

Guidance literature:

With sodium hydroxide; In tert-butyl alcohol; at 110 ℃; for 24h; regioselective reaction; Sealed tube;

DOI:10.1039/c9cc03375k

Reference yield: 69.0%

1-[(2-aminophenyl)morpholin-4-yl-methyl]naphthalen-2-ol → benz[a]acridine (225-11-6)

Guidance literature:

With 5%-palladium/activated carbon; hydrogen; In ethanol; for 5h; under 760.051 Torr;

DOI:10.1002/open.201900150

Reference yield: 65.0%

7,12-dihydro-benzo[a]acridine (32638-83-8) → benz[a]acridine (225-11-6)

Guidance literature:

With potassium dichromate; sulfuric acid; In water; for 0.25h; Heating;

DOI:10.1039/P19800001233

upstream raw materials:

8,9,10,11-tetrahydro-benzo[a]acridine

7,12-dihydro-benzo[a]acridine

2-Nitrobenzyl alcohol

N-Phenyl-2-naphthylamine

Refernces

• 1、 Szatmári, István,Belasri, Khadija,Heydenreich, Matthias,Koch, Andreas,Kleinpeter, Erich,Fül?p, Ferenc. "Ortho-Quinone Methide Driven Synthesis of New O,N- or N,N-Heterocycles". . p. 961 - 971. Retrieved 2019.
• 2、 -. "Nitrogen anthracene class compound and its synthetic method and application (by machine translation)". Paragraph 0103-0106. . Retrieved 2018/05/16.