2,3-Naphthalenedicarboxylic acid, 1-hydroxy-4-phenyl-, dimethyl ester

Base Information

• Chemical Name: 2,3-Naphthalenedicarboxylic acid, 1-hydroxy-4-phenyl-, dimethyl ester
• CAS No.: 37806-17-0
• Molecular Formula: C20H16O5
• Molecular Weight: 336.344
• DSSTox Substance ID: DTXSID20482743
• Wikidata: Q82319397
• Mol file: 37806-17-0.mol

Synonyms:37806-17-0;2,3-Naphthalenedicarboxylic acid, 1-hydroxy-4-phenyl-, dimethyl ester;DTXSID20482743

Chemical Property of 2,3-Naphthalenedicarboxylic acid, 1-hydroxy-4-phenyl-, dimethyl ester

Chemical Property:

• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 336.09977361
• Heavy Atom Count: 25
• Complexity: 485

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C(C2=CC=CC=C2C(=C1C(=O)OC)O)C3=CC=CC=C3

Technology Process of 2,3-Naphthalenedicarboxylic acid, 1-hydroxy-4-phenyl-, dimethyl ester

There total 9 articles about 2,3-Naphthalenedicarboxylic acid, 1-hydroxy-4-phenyl-, dimethyl ester 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: 86.0%

methanol (67-56-1) + 4-Hydroxy-9-phenyl-naphtho[2,3-c]furan-1,3-dione (116515-53-8) → dimethyl 1-hydroxy-4-phenyl-2,3-naphthalenedicarboxylate (37806-17-0)

Guidance literature:

With hydrogenchloride; for 0.833333h;

Reference yield: 84.0%

(9R,10R)-1-(tert-Butyl-dimethyl-silanyloxy)-8-phenyl-11-oxa-tricyclo[6.2.1.02,7]undeca-2(7),3,5-triene-9,10-dicarboxylic acid dimethyl ester (92753-26-9) → dimethyl 1-hydroxy-4-phenyl-2,3-naphthalenedicarboxylate (37806-17-0)

Guidance literature:

With trifluoroacetic acid; Ambient temperature;

DOI:10.1246/cl.1984.1263

Reference yield: 60.0%

1,3-dihydro-1-hydroxy-1-phenylisobenzofuran (114469-14-6) + dimethyl acetylenedicarboxylate (762-42-5) → dimethyl 1-hydroxy-4-phenyl-2,3-naphthalenedicarboxylate (37806-17-0)

Guidance literature:

With toluene-4-sulfonic acid; In benzene; for 2h; Heating;

upstream raw materials:

methanol

4-Hydroxy-9-phenyl-naphtho[2,3-c]furan-1,3-dione

2-benzofuran-1(3H)-one

phenyllithium

Downstream raw materials:

4-hydroxy-9-phenylnaphtho<2,3-c>furan-1-(3H)-one

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