Methyl 2,5-dimethoxybenzoate

Base Information

• Chemical Name: Methyl 2,5-dimethoxybenzoate
• CAS No.: 2150-40-5
• Molecular Formula: C10H12O4
• Molecular Weight: 196.203
• Hs Code.: 2918990090
• European Community (EC) Number: 661-799-5
• DSSTox Substance ID: DTXSID00374935
• Nikkaji Number: J504.778A
• Wikidata: Q63391642
• ChEMBL ID: CHEMBL2252253
• Mol file: 2150-40-5.mol

Synonyms:methyl 2,5-dimethoxybenzoate;2150-40-5;MFCD00060624;2,5-dimethoxybenzoic acid methyl ester;METHYL2,5-DIMETHOXYBENZOATE;SCHEMBL2091289;CHEMBL2252253;Methyl 2,5-dimethoxybenzoate #;DTXSID00374935;AKAPOSLZQKGWGT-UHFFFAOYSA-N;CAA15040;AKOS005151300;2,5-dimethoxy-benzoic acid methyl ester;Benzoic acid,2,5-dimethoxy-,methyl ester;SY253219;Gentisic acid, dimethyl ether, methyl ester;AM20030352;CS-0433784;FT-0676208;F71842;A815423;Q63391642

Chemical Property of Methyl 2,5-dimethoxybenzoate

Chemical Property:

• Vapor Pressure: 0.00141mmHg at 25°C
• Refractive Index: 1.497
• Boiling Point: 296.7 °C at 760 mmHg
• Flash Point: 129 °C
• PSA: 44.76000
• Density: 1.119 g/cm³
• LogP: 1.49040
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 196.07355886
• Heavy Atom Count: 14
• Complexity: 193

Purity/Quality:

98%Min ^*data from raw suppliers

Methyl2,5-Dimethoxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)OC)C(=O)OC

Technology Process of Methyl 2,5-dimethoxybenzoate

There total 15 articles about Methyl 2,5-dimethoxybenzoate 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: 96.0%

2,5-dihydroxybenzoic acid. (490-79-9) + methyl iodide (74-88-4) → methyl 2,5-dimethoxybenzoate (2150-40-5)

Guidance literature:

2,5-dihydroxybenzoic acid.; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; for 1h; Cooling with ice;

methyl iodide; In N,N-dimethyl-formamide; mineral oil; at 20 ℃; for 3h; Cooling with ice;

DOI:10.1002/chir.22447

Reference yield: 93.0%

methanol (67-56-1) + 2,5-dimethoxybenzoic acid (2785-98-0) → methyl 2,5-dimethoxybenzoate (2150-40-5)

Guidance literature:

With sulfuric acid; at 70 ℃;

Reference yield: 93.0%

2,5-dimethoxybenzyl alcohol (33524-31-1) + potassium methanolate (865-33-8) → methyl 2,5-dimethoxybenzoate (2150-40-5)

Guidance literature:

With tellurium; bismuth (III) nitrate pentahydrate; 5%-palladium/activated carbon; oxygen; In methanol; at 60 ℃; for 8h; under 760.051 Torr;

DOI:10.1021/ol402428e

upstream raw materials:

methanol

2,5-dimethoxybenzoic acid

diazomethane

2,5-dihydroxybenzoic acid.

Downstream raw materials:

2,5-dimethoxybenzoic acid

2,5-dimethoxyaniline

C₁₅H₁₆N₂O₄

C₁₅H₁₆N₂O₄

Refernces

• 1、 Natori, Koichi,Iwayama, Taizo,Yamabe, Osamu,Kitamoto, Yuichi,Ikeda, Hiroshi,Sakamoto, Kenkichi,Hattori, Tetsutaro,Miyano, Sotaro. "Photoracemization of Blestriarene C and Its Analogs". . p. 479 - 486. Retrieved 2015.
• 2、 -. "COMPOUNDS". Page/Page column 56-57. . Retrieved 2020/01/24.
• 3、 Okada, Yohei,Sugai, Masae,Chiba, Kazuhiro. "Hydrogen-Bonding-Induced Fluorescence: Water-Soluble and Polarity-Independent Solvatochromic Fluorophores". . p. 10922 - 10929. Retrieved 2016/11/29.