Methyl 9-acridinecarboxylate

Base Information

• Chemical Name: Methyl 9-acridinecarboxylate
• CAS No.: 5132-81-0
• Molecular Formula: C15H11 N O2
• Molecular Weight: 237.258
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20199324
• Nikkaji Number: J55.096E
• Wikidata: Q83072230
• Mol file: 5132-81-0.mol

Synonyms:Methyl 9-acridinecarboxylate;Methyl acridine-9-carboxylate;5132-81-0;Acridine, 9-methoxycarbonyl-;9-ACRIDINECARBOXYLIC ACID, METHYL ESTER;5-Carbomethoxyacridine (European);BRN 0193562;5-22-03-00413 (Beilstein Handbook Reference);5-Carbomethoxyacridine;methyl acridin-9-carboxylate;Methyl 9-acridinecarboxylate #;SCHEMBL2443270;DTXSID20199324;AKOS030239777;acridine-9-carboxylic acid methyl ester;BS-52049;FT-0671431;E79424

Chemical Property of Methyl 9-acridinecarboxylate

Chemical Property:

• Vapor Pressure: 4.72E-07mmHg at 25°C
• Boiling Point: 413.6°C at 760 mmHg
• Flash Point: 204°C
• PSA: 39.19000
• Density: 1.256g/cm³
• LogP: 3.17460
• Solubility.: Chloroform
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 237.078978594
• Heavy Atom Count: 18
• Complexity: 296

Purity/Quality:

97% ^*data from raw suppliers

Methyl9-Acridinecarboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C2C=CC=CC2=NC3=CC=CC=C31
• Uses: Methyl 9-Acridinecarboxylate (cas# 5132-81-0) is a compound useful in organic synthesis.

Technology Process of Methyl 9-acridinecarboxylate

There total 9 articles about Methyl 9-acridinecarboxylate 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: 95.0%

diazomethane (186581-53-3,908094-01-9,334-88-3) + acridine-9-carboxylic acid (5336-90-3) → methyl acridine-9-carboxylate (5132-81-0)

Guidance literature:

In dichloromethane; at 0 ℃; for 0.25h;

Reference yield: 86.0%

methanol (67-56-1) + 9-acridinecarbonyl chloride (66074-67-7) → methyl acridine-9-carboxylate (5132-81-0)

Guidance literature:

DOI:10.1016/S0040-4039(00)61545-9

Reference yield: 84.0%

methanol (67-56-1) + 1-phenyl-indole-2,3-dione (723-89-7) → methyl acridine-9-carboxylate (5132-81-0)

Guidance literature:

With trifluorormethanesulfonic acid; at 100 ℃; for 12h; Reagent/catalyst; Temperature; Sealed tube;

DOI:10.1039/d0ob01824d

upstream raw materials:

diazomethane

acridine-9-carboxylic acid

methanol

9-acridinecarbonyl chloride

Downstream raw materials:

9-[(carbonyl)methoxy]-10-methylacridinium methylsulfate

N-methyldibenzazepine

9-ethoxycarbonyl-10-methylacridane

9-Bromomethyl-10-methyl-9,10-dihydro-acridine-9-carboxylic acid ethyl ester