Diethyl naphthalene-1,8-dicarboxylate

Base Information

• Chemical Name: Diethyl naphthalene-1,8-dicarboxylate
• CAS No.: 58618-39-6
• Molecular Formula: C16H16 O4
• Molecular Weight: 272.301
• NSC Number: 99902
• DSSTox Substance ID: DTXSID60295152
• Wikidata: Q82034913
• Mol file: 58618-39-6.mol

Synonyms:diethyl naphthalene-1,8-dicarboxylate;58618-39-6;NSC99902;NCIOpen2_007063;SCHEMBL3681837;DTXSID60295152;NSC-99902;naphthalene-1,8-dicarboxylic acid diethyl ester

Chemical Property of Diethyl naphthalene-1,8-dicarboxylate

Chemical Property:

• Vapor Pressure: 1.28E-06mmHg at 25°C
• Boiling Point: 400.3°Cat760mmHg
• Flash Point: 199.7°C
• Density: 1.171g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 272.10485899
• Heavy Atom Count: 20
• Complexity: 320

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=CC2=C1C(=CC=C2)C(=O)OCC

Technology Process of Diethyl naphthalene-1,8-dicarboxylate

There total 3 articles about Diethyl naphthalene-1,8-dicarboxylate 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:

ethanol (64-17-5) + naphthalene-1,8-dicarboxylic acid dichloride (6423-29-6) → 1,8-Naphthalic anhydride (81-84-5) + naphthalene-1,8-dicarboxylic acid diethyl ester (58618-39-6)

Guidance literature:

With chloroform;

Reference yield:

ethyl iodide (75-03-6) → naphthalene-1,8-dicarboxylic acid diethyl ester (58618-39-6)

Guidance literature:

at 100 ℃;

Reference yield:

ethanol (64-17-5) + dimethyl naphthalene-1,8-dicarboxylate (10060-33-0) → naphthalene-1,8-dicarboxylic acid diethyl ester (58618-39-6)

Guidance literature:

With sodium ethanolate;

upstream raw materials:

ethanol

dimethyl naphthalene-1,8-dicarboxylate

naphthalene-1,8-dicarboxylic acid dichloride

ethyl iodide