Methyl 9-anthracenecarboxylate

Base Information

• Chemical Name: Methyl 9-anthracenecarboxylate
• CAS No.: 1504-39-8
• Molecular Formula: C16H12 O2
• Molecular Weight: 236.27
• Hs Code.: 2916399090
• European Community (EC) Number: 661-316-8
• NSC Number: 176183
• DSSTox Substance ID: DTXSID50933935
• Nikkaji Number: J80.213A
• Wikidata: Q82909763
• Mol file: 1504-39-8.mol

Synonyms:1504-39-8;methyl anthracene-9-carboxylate;9-Anthracenecarboxylic acid methyl ester;Methyl 9-anthracenecarboxylate;9-Methoxycarbonylanthracene;9-Anthracenecarboxylic acid methyl;9-Anthracenecarboxylic acid, methyl ester;Methyl 9-anthroate;9-Anthroic acid, methyl ester;methylanthracene-9-carboxylate;SCHEMBL10559440;DTXSID50933935;NSC176183;AKOS015852095;NSC 176183;NSC-176183;Anthracene-9-carboxylic acid methyl ester;FT-0658026;A809045

Chemical Property of Methyl 9-anthracenecarboxylate

Chemical Property:

• Vapor Pressure: 8.81E-07mmHg at 25°C
• Boiling Point: 405.4°C at 760 mmHg
• Flash Point: 194.3°C
• PSA: 26.30000
• Density: 1.208g/cm³
• LogP: 3.77960
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 236.083729621
• Heavy Atom Count: 18
• Complexity: 290

Purity/Quality:

98.5% ^*data from raw suppliers

Methylanthracene-9-carboxylate 95+% ^*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=CC3=CC=CC=C31

Technology Process of Methyl 9-anthracenecarboxylate

There total 24 articles about Methyl 9-anthracenecarboxylate 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: 97.0%

nitrate de methoxycarbonyl-10 anthracenediazonium-9 → anthracene-9-carboxylic acid methyl ester (1504-39-8)

Guidance literature:

With diethyl ether; for 360h;

Reference yield: 95.0%

anthracen-9-carboxylic acid (723-62-6) + diazomethyl-trimethyl-silane (18107-18-1) → anthracene-9-carboxylic acid methyl ester (1504-39-8)

Guidance literature:

In methanol; Heating;

DOI:10.1002/jhet.5570380202

Reference yield: 78.0%

methanol (67-56-1) + anthracen-9-carboxylic acid (723-62-6) → anthracene-9-carboxylic acid methyl ester (1504-39-8)

Guidance literature:

anthracen-9-carboxylic acid; With trifluoroacetic anhydride; In toluene; for 0.75h;

methanol; In toluene; for 3h;

DOI:10.1021/ja0608747

upstream raw materials:

methanol

9-anthracenecarbonyl chloride

2,2-Bis(1,2,4-triazol-1-yl)dibenzo-2-thiabicyclo<2.2.2>octane

methyl 10-amino-9-anthracenecarboxylate

Downstream raw materials:

methyl-N-3,7-dimethyl-7-hydroxyoctylidene anthranilate

Refernces

• 1、 Ganguly, Aniruddha,Jana, Sankar,Ghosh, Soumen,Dalapati, Sasanka,Guchhait, Nikhil. "Solvent modulated photophysics of 9-methyl anthroate: Exploring the effect of polarity and hydrogen bonding on the emissive state". . p. 237 - 244. Retrieved 2013.
• 2、 Menger, Fredric M.,Sorrells, Jennifer L.. "A non-steroidal facial amphiphile". . p. 4960 - 4961. Retrieved 2006.
• 3、 Cohen,Connors. "". . p. 1271,1272. Retrieved 1970.
• 4、 Ishida, Takumi,Nishihara, Yasushi,Wang, Xiu,Wang, Zhenhua. "Methoxylation of Acyl Fluorides with Tris(2,4,6-trimethoxyphenyl)phosphine via C-OMe Bond Cleavage under Metal-Free Conditions". . p. 7526 - 7533. Retrieved 2020/06/27.